Name: Name:6H-Purin-6-one, 2-chloro-1,7-dihydro-7-methyl-
Brand: Angene
SKU: AG001RPU
Rating: 90 (10 reviews)

6H-Purin-6-one, 2-chloro-1,7-dihydro-7-methyl-

CAS No.:

16017-76-8

Catalog Number:

AG001RPU

Molecular Formula:

C6H5ClN4O

Molecular Weight:

184.5831

Catalog Number:

AG001RPU

Chemical Name:

6H-Purin-6-one, 2-chloro-1,7-dihydro-7-methyl-

CAS Number:

16017-76-8

Molecular Formula:

C6H5ClN4O

Molecular Weight:

184.5831

MDL Number:

MFCD00047225

IUPAC Name:

2-chloro-7-methyl-1H-purin-6-one

InChI:

InChI=1S/C6H5ClN4O/c1-11-2-8-4-3(11)5(12)10-6(7)9-4/h2H,1H3,(H,9,10,12)

InChI Key:

HTRDGUDBXFNIOU-UHFFFAOYSA-N

SMILES:

Clc1nc2ncn(c2c(=O)[nH]1)C

NSC Number:

7860

Complexity:

254

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

184.015g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

184.583g/mol

Monoisotopic Mass:

184.015g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

59.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.5