9-Benzyl-9H-purine

HCID 234701
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Basic information

CAS
25491-56-9
Standard SMILES
c1ccc(Cn2cnc3cncnc32)cc1
InChIKey
MDOUSORGCMUMBO-UHFFFAOYSA-N
Molecular formula
C12H10N4
Average molar mass
210.23 g/mol
Monoisotopic mass
210.09054632

Names & identifiers

Preferred name
9-Benzyl-9H-purine
IUPAC
9-benzylpurine
English name
9H-Purine,9-(phenylmethyl)-
Molecular formula
C12H10N4
Molecular weight
210.23

Names & synonyms

9-Benzyl-9H-purine9-benzylpurine25491-56-99H-Purine, 9-(phenylmethyl)-NSC35001SCHEMBL434620CHEMBL267242SCHEMBL15156834SCHEMBL15156835DTXSID90284034MDOUSORGCMUMBO-UHFFFAOYSA-NNSC-35001
Show more names
9H-Purine,9-(phenylmethyl)-

Database identifiers

CAS
25491-56-9
PubChem CID
234701
DTXSID
DTXSID90284034
ChEMBL
CHEMBL267242
Nikkaji
J1.070.700E

Properties

Computed structural properties

XLogP
2
Topological polar surface area
43.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
16

Chemistry & industry

Suppliers3 total

杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
上海昂提生物科技有限公司13764913901 · [email protected]
天津希恩思生化科技有限公司400-6387771-6039 18920764717 · [email protected]

Related reactions

6 records
New reaction record

Compound notes

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