Basic information
- Name:
Guanosine,8-(phenylmethoxy)-
- Superlist Name:
- 8-Benzyloxyguanosine
- CAS No.:
3868-36-8
- Molecular Structure:
- Formula:
- C17H19 N5 O6
- Molecular Weight:
- 389.36
- Synonyms:
- Guanosine,8-(benzyloxy)- (7CI,8CI); 8-(Benzyloxy)guanosine; NSC 90391
- Density:
- 1.8g/cm3
- Boiling Point:
- 772°Cat760mmHg
- Flash Point:
- 420.7°C
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Chemistry
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IUPAC Name: 2-Amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-8-phenylmethoxy-3H-purin-6-one
Canonical SMILES: C1=CC=C(C=C1)COC2=NC3=C(N2C4C(C(C(O4)CO)O)O)NC(=NC3=O)N
InChI: InChI=1S/C17H19N5O6/c18-16-20-13-10(14(26)21-16)19-17(27-7-8-4-2-1-3-5-8)22(13)15-12(25)11(24)9(6-23)28-15/h1-5,9,11-12,15,23-25H,6-7H2,(H3,18,20,21,26)
InChIKey: RNSGUQLXDMZREX-UHFFFAOYSA-N
Molecular Weight: 389.36266 [g/mol]
Molecular Formula: C17H19N5O6
XLogP3-AA: -0.9
H-Bond Donor: 5
H-Bond Acceptor: 9
Rotatable Bond Count: 5
Tautomer Count: 9
Exact Mass: 389.133533
MonoIsotopic Mass: 389.133533
Topological Polar Surface Area: 164
Heavy Atom Count: 28
Complexity: 615
Index of Refraction: 1.796
Molar Refractivity: 91.915 cm3
Molar Volume: 215.903 cm3
Surface Tension: 83.74 dyne/cm
Density of 8-Benzyloxyguanosine (CAS NO.3868-36-8): 1.803 g/cm3
Specification
8-Benzyloxyguanosine (CAS NO.3868-36-8), its Synonyms are Guanosine, 8-(phenylmethoxy)- ; 2-Amino-8-benzyloxy-9-(3,4-dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-1,9-dihydro-purin-6-one .
