AG00IBDV

Name: 2-(Benzylthio)-9H-purin-6-amine
Brand: Angene Chemical
SKU: AG00IBDV

64542-91-2 | 2-(Benzylthio)-9H-purin-6-amine

AG00IBDV

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CAS Number	64542-91-2
Catalog Number	AG00IBDV(AGN-PC-0OESWT)
Chemical Name	2-(Benzylthio)-9H-purin-6-amine
IUPAC Name	2-benzylsulfanyl-7H-purin-6-amine
InChI	InChI=1S/C12H11N5S/c13-10-9-11(15-7-14-9)17-12(16-10)18-6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H3,13,14,15,16,17)
InChI Key	REPIAJURENEHOZ-UHFFFAOYSA-N
MDL Number	MFCD30729982
Molecular Formula	C12H11N5S
Molecular Weight	257.3142
NSC Number	210299
SMILES	NC1=C2N=CNC2=NC(SCC3=CC=CC=C3)=N1
Synonyms	2-(Benzylthio)-9H-purin-6-amine, 64542-91-2, 2-benzylsulfanyl-7H-purin-6-amine, AC1N1YBD, SCHEMBL4152240, DTXSID40398695, REPIAJURENEHOZ-UHFFFAOYSA-N, KS-00000U8P, ZINC4773366, MFCD30729982, NSC210299, AKOS030631696, NSC-210299, AK683637, DS-20079, 2-Benzylthioadenin, ACN-043810, CID4038089,

Complexity	271
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	257.074g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	257.315g/mol
Monoisotopic Mass	257.074g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	106A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited