Cas no 32659-29-3 (6H-Furo[2',3':4,5]oxazolo[3,2-a]pyrimidin-3-ol,2-(chloromethyl)-2,3,3a,9a-tetrahydro-6-imino-, hydrochloride (1:1),(2S,3S,3aS,9aR)-)
32659-29-3 structure
Product Name:6H-Furo[2',3':4,5]oxazolo[3,2-a]pyrimidin-3-ol,2-(chloromethyl)-2,3,3a,9a-tetrahydro-6-imino-, hydrochloride (1:1),(2S,3S,3aS,9aR)-
CAS No:32659-29-3
MF:C9H10ClN3O3
MW:243.647000789642
CID:318768
PubChem ID:432921
Update Time:2025-04-19
6H-Furo[2',3':4,5]oxazolo[3,2-a]pyrimidin-3-ol,2-(chloromethyl)-2,3,3a,9a-tetrahydro-6-imino-, hydrochloride (1:1),(2S,3S,3aS,9aR)- Chemical and Physical Properties
Names and Identifiers
-
- 6H-Furo[2',3':4,5]oxazolo[3,2-a]pyrimidin-3-ol,2-(chloromethyl)-2,3,3a,9a-tetrahydro-6-imino-, hydrochloride (1:1),(2S,3S,3aS,9aR)-
- 2-(chloromethyl)-6-imino-2,3,3a,9a-tetrahydrofuro[1,2][1,3]oxazolo[3,4-a]pyrimidin-3-ol
- (3aS)-6-amino-2t-chloromethyl-3c-hydroxy-(3ar,9ac)-2,3,3a,9a-tetrahydro-furo[2',3':4,5]oxazolo[3,2-a]pyrimidinylium, chloride
- 2-(Chloromethyl)-6-imino-2,3,3a,9a-tetrahydro-6H-furo(2',3':4,5)(1,3)oxazolo(3,2-a)pyrimidin-3-ol
- 2-(Chloromethyl)-6-imino-2,3,3a,9a-tetrahydro-6H-furo[2',3':4,5][1,3]oxazolo[3,2-a]pyrimidin-
- 5'-chloro-arabino-2,2'-anhydro-5'-deoxy-cytidinium, chloride
- 5'-chlorocyclocytidine hydrochloride
- AC1L8UF3
- NSC318797
- 2-(Chloromethyl)-6-imino-2,3,3a,9a-tetrahydro-6H-furo[2',3':4,5][1,3]oxazolo[3,2-a]pyrimidin-3-ol
- DTXSID00875790
- NSC-318797
- 32659-29-3
- 5CHLOROCYCLOCYTOSINE
- NSC 318797
- 2-(chloromethyl)-6-imino-2,3,3a,9a-tetrahydrofuro[[?]:[?]]oxazolo[[?]]pyrimidin-3-ol
-
- Inchi: 1S/C9H10ClN3O3/c10-3-4-6(14)7-8(15-4)13-2-1-5(11)12-9(13)16-7/h1-2,4,6-8,11,14H,3H2
- InChI Key: KSCUAPCTLRFVPI-UHFFFAOYSA-N
- SMILES: ClCC1C(C2C(N3C=CC(=N)N=C3O2)O1)O
Computed Properties
- Exact Mass: 243.0412
- Monoisotopic Mass: 243.041
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 1
- Complexity: 398
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 4
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: _1.6
- Topological Polar Surface Area: 78.1?2
Experimental Properties
- Density: 1.96
- Boiling Point: 403.7°C at 760 mmHg
- Flash Point: 197.9°C
- Refractive Index: 1.812
- PSA: 78.14
- LogP: -0.27960
6H-Furo[2',3':4,5]oxazolo[3,2-a]pyrimidin-3-ol,2-(chloromethyl)-2,3,3a,9a-tetrahydro-6-imino-, hydrochloride (1:1),(2S,3S,3aS,9aR)- Related Literature
-
Somenath Panda,Kaushik Kundu,Anusha Basaiahgari,Sanjib Senapati,Ramesh L. Gardas New J. Chem., 2018,42, 7105-7118
-
Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
32659-29-3 (6H-Furo[2',3':4,5]oxazolo[3,2-a]pyrimidin-3-ol,2-(chloromethyl)-2,3,3a,9a-tetrahydro-6-imino-, hydrochloride (1:1),(2S,3S,3aS,9aR)-) Related Products
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