C9H10N2O5 6H-FURO [2 ′, 3 ′: 4,5] oxazolo [3,2-a] pyrimidin-6-moja, 2,3,3a, 9a-tetrah ydro-3-hydroxy-2- (hydroxymelyl)-, (2r, 3 r, 9ar)-(9c)-(9c)-(9C) (9, 3AS)-9AR) (9, 3AS)-9AR)-9AR.

Bidhaa

C9H10N2O5 6H-FURO [2 ′, 3 ′: 4,5] oxazolo [3,2-a] pyrimidin-6-moja, 2,3,3a, 9a-tetrah ydro-3-hydroxy-2- (hydroxymelyl)-, (2r, 3 r, 9ar)-(9c)-(9c)-(9C) (9, 3AS)-9AR) (9, 3AS)-9AR)-9AR.

Habari ya kimsingi:


Maelezo ya bidhaa

Vitambulisho vya bidhaa

Maelezo ya dutu

Nambari ya Usajili wa CAS

3736-77-4

Sifa muhimu za mwili Thamani Hali
Uzito wa Masi 226.19 -
Hatua ya kuyeyuka (majaribio) 234-235 ° C. -
Kiwango cha kuchemsha (kilitabiriwa) 456.3 ± 55.0 ° C. Bonyeza: 760 Torr
Uzani (uliotabiriwa) 2.01 ± 0.1 g/cm3 Temp: 20 ° C; Bonyeza: 760 Torr
PKA (alitabiri) 12.55 ± 0.40 Templeti nyingi za asidi: 25 ° C.

Majina mengine na vitambulisho

Tabasamu za Canonical
O = C1N = C2OC3C (O) C (OC3N2C = C1) CO
Tabasamu za Isomeric
O [c@h] 1 [c@] 2 ([c@] (n3c (o2) = nc (= o) c = c3) (o [c @@ h] 1co) [h]) [h]
Inchi
Inchi = 1S/C9H10N2O5/C12-3-4-6 (14) 7-8 (15-4) 11-2-1-5 (13) 10-9 (11) 16-7/H1-2,4,6-8,12,14h, 3h2/t4-, 6-, 7+, 8-/m1/s1
Ufunguo wa Inchi
UUGITDASWNOAGG-CCXZUQQUSA-N
Majina mengine 13 kwa dutu hii
. 6H-Furo [2 ′, 3 ′: 4,5] oxazolo [3,2-a] pyrimidin-6-moja, 2,3,3a, 9a-tetrahydro-3-hydroxy-2- (hydroxymethyl)-(6ci, 7ci); 6H-Furo [2 ′, 3 ′: 4,5] oxazolo [3,2-a] pyrimidin-6-moja, 2,3,3a, 9a-tetrahydro-3-hydroxy-2- (hydroxymethyl)-, [2r- (2α, 3β, 3Aβ)-(Zc)); 6H-Furo [2 ′, 3 ′: 4,5] oxazolo [3,2-a]

pyrimidin-6-moja, 2,3,3a, 9a-tetrahydro-3-hydroxy-2- (hydroxymethyl)-, stereoisomer (8ci); 2,2 ′ -anhydro (1- β -d -arabinofuranosyl) uracil; 2,2 ′ -anhydro-1- β -D-Arabino-Furanosyluracil; 2,2 ′ -anhydro-n1- (β -d-arabinofuranosyl) uracil; 2,2 ′ -anhydrouridine; 2,2 ′ -O -cyclouridine; NSC 157148; O2,2 ′ -anhydrouridine; O2,2 ′ -cyclouridine; β -D-2 ′, 2-O-cycloarabinouridine

Mali ya majaribio

Mali inapatikana
Macho na kutawanya
Mafuta

Optical na scaring

Mali Thamani Hali Chanzo
Nguvu ya mzunguko wa macho -19 deg Kutengenezea: methanoli; λ: 589.3 nm; Temp: 26 ° c (1) CAS

(1) Codington, John F.; Jarida la Jumuiya ya Kemikali ya Amerika, (1961), 83, 5030-1, Caplus

Mafuta

Mali Thamani Hali Chanzo
Hatua ya kuyeyuka 250-253 ° C.   (1) CAS
Hatua ya kuyeyuka 246 ° C. Kutengenezea: ethanol; Isopropanol (2) CAS
Hatua ya kuyeyuka 242-245 ° C.   (3) CAS
Hatua ya kuyeyuka 242-243 ° C.   (4) CAS
Hatua ya kuyeyuka 236-238 ° C (DECOMP)   (5) CAS
Hatua ya kuyeyuka 234 ° C.   (6) CAS
Hatua ya kuyeyuka 234-235 ° C.   (7) CAS
Hatua ya kuyeyuka 233-234 ° C (kutengana) Kutengenezea: methanoli (8) CAS
Hatua ya kuyeyuka Tazama maandishi kamili   (9) CAS

(1) Lin, Kun-I.; Jarida la Jumuiya ya Kemikali ya China (Taipei, Taiwan), (2007), 54 (2), 563-568, Caplus

(2) Takatsuki, Ken-Ichi; Nucleosides, Nucleotides & Asidi ya Nyuklia, (2006), 25 (7), 719-734, Caplus

(3) Wnuk, Stanislaw F.; Jarida la Kemia ya Kikaboni, (2002), 67 (6), 1816-1819, Caplus

(4) Szlenkier, Maurycy; Nucleosides, Nucleotides & Acids ya Nyuklia, (2016), 35 (8), 410-425, Caplus

(5) Marumoto, Ryuji; Takeda Kenkyusho Nenpo, (1967), 26, 21-3, Caplus

(6) Krizmanic, Irena; Tetrahedron, (2003), 59 (23), 4047-4057, Caplus

(7) Brown, DM; Jarida la Jumuiya ya Kemikali, (1958), 3035-8, Caplus

(8) li, heting; Mawasiliano ya Syntetisk, (2006), 36 (14), 1933-1940, Caplus

(9) Codington, John F.; Jarida la Jumuiya ya Kemikali ya Amerika, (1961), 83, 5030-1, Caplus

Majaribio ya majaribio

Spectra inapatikana
1 H NMR
13 C NMR
IR
Spectra inapatikana
Misa

Mali zilizotabiriwa

Mali inapatikana
Kibaolojia
Kemikali
Wiani
Lipinski
Muundo unaohusiana
Mafuta

Kibaolojia

Mali Thamani Hali Chanzo
Sababu ya bioconcentration 1.0 pH 1; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1.0 pH 2; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1.0 pH 3; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1.0 pH 4; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1.0 pH 5; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1.0 pH 6; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1.0 pH 7; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1.0 pH 8; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1.0 pH 9; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1.0 pH 10; Temp: 25 ° c (1) ACD

.

Kemikali

Mali Thamani Hali Chanzo
KOC 7.66 pH 1; Temp: 25 ° c (1) ACD
KOC 7.66 pH 2; Temp: 25 ° c (1) ACD
KOC 7.66 pH 3; Temp: 25 ° c (1) ACD
KOC 7.66 pH 4; Temp: 25 ° c (1) ACD
KOC 7.66 pH 5; Temp: 25 ° c (1) ACD
KOC 7.66 pH 6; Temp: 25 ° c (1) ACD
KOC 7.66 pH 7; Temp: 25 ° c (1) ACD
KOC 7.66 pH 8; Temp: 25 ° c (1) ACD

 

Mali Thamani Hali Chanzo
KOC 7.66 pH 9; Temp: 25 ° c (1) ACD
KOC 7.64 pH 10; Temp: 25 ° c (1) ACD
logi -0.91 pH 1; Temp: 25 ° c (1) ACD
logi -0.91 pH 2; Temp: 25 ° c (1) ACD
logi -0.91 pH 3; Temp: 25 ° c (1) ACD
logi -0.91 pH 4; Temp: 25 ° c (1) ACD
logi -0.91 pH 5; Temp: 25 ° c (1) ACD
logi -0.91 pH 6; Temp: 25 ° c (1) ACD
logi -0.91 pH 7; Temp: 25 ° c (1) ACD
logi -0.91 pH 8; Temp: 25 ° c (1) ACD
logi -0.91 pH 9; Temp: 25 ° c (1) ACD
logi -0.91 pH 10; Temp: 25 ° c (1) ACD
Logp -0.906 ± 0.555 Temp: 25 ° c (1) ACD
Umumunyifu wa ndani 4.7 g/l Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 4.7 g/l pH 1; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 4.7 g/l pH 2; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 4.7 g/l pH 3; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 4.7 g/l pH 4; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 4.7 g/l pH 5; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 4.7 g/l pH 6; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 4.7 g/l pH 7; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 4.7 g/l pH 8; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 4.7 g/l pH 9; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 4.7 g/l pH 10; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 4.7 g/l Maji yasiyokuwa na maji pH 6.91; Temp: 25 ° c (1) ACD
Umumunyifu wa ndani wa molar 0.021 mol/L. Temp: 25 ° c (1) ACD
Umumunyifu wa molar 0.021 mol/L. pH 1; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 0.021 mol/L. pH 2; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 0.021 mol/L. pH 3; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 0.021 mol/L. pH 4; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 0.021 mol/L. pH 5; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 0.021 mol/L. pH 6; Temp: 25 ° c (1) ACD

 

Mali Thamani Hali Chanzo
Umumunyifu wa molar 0.021 mol/L. pH 7; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 0.021 mol/L. pH 8; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 0.021 mol/L. pH 9; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 0.021 mol/L. pH 10; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 0.021 mol/L. Maji yasiyokuwa na maji pH 6.91; Temp: 25 ° c (1) ACD
Uzito wa Masi 226.19    
PKA 12.55 ± 0.40 Templeti nyingi za asidi: 25 ° C. (1) ACD
PKA -4.68 ± 0.60 Muda wa msingi zaidi: 25 ° C. (1) ACD
Shinikizo la mvuke 3.04 x 10-10 Torr Temp: 25 ° c (1) ACD

.

Wiani

Mali Thamani Hali Chanzo
Wiani 2.01 ± 0.1 g/cm3 Temp: 20 ° C; Bonyeza: 760 Torr (1) ACD
Kiasi cha molar 112.3 ± 7.0 cm3/mol Temp: 20 ° C; Bonyeza: 760 Torr (1) ACD

.

Lipinski

Mali Thamani Hali Chanzo
Vifungo vya mzunguko wa bure 3 (1) ACD
Wapokeaji 7 (1) ACD
H wafadhili 2 (1) ACD
H wafadhili/jumla ya jumla 9 (1) ACD
Logp -0.906 ± 0.555 Temp: 25 ° c (1) ACD
Uzito wa Masi 226.19

.

Muundo unaohusiana

Mali Thamani Chanzo cha hali
Eneo la uso wa polar 91.6 A2 (1) ACD

.

Mafuta

Mali Thamani Hali Chanzo
Kiwango cha kuchemsha 456.3 ± 55.0 ° C. Bonyeza: 760 Torr (1) ACD

 

Mali Thamani Hali Chanzo
Enthalpy ya mvuke 82.62 ± 6.0 kJ/mol Bonyeza: 760 Torr (1) ACD
Kiwango cha Flash 229.8 ± 31.5 ° C.   (1) ACD

.

Utabiri uliotabiriwa

Spectra inapatikana
1 H NMR
13 C NMR

Taarifa za hatari za GHS

Chanzo cha Taarifa ya Hatari ya Msimbo
H302 inadhuru ikiwa imemezwa Uainishaji wa Wakala wa Kemikali wa Ulaya (ECHA) na uandishi

Uainishaji - Uainishaji ulioarifiwa na Uandishi - Arifa za Kawaida, Wakala wa Kemikali wa Ulaya (ECHA)

Uainishaji na Uainishaji wa Uainishaji - Uainishaji ulioarifiwa na Uandishi - Arifa kubwa zaidi


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