Name: Name:2-(6-chloro-9H-purin-9-yl)acetic acid
Brand: Angene
SKU: AG01B26G
Rating: 90 (10 reviews)

2-(6-chloro-9H-purin-9-yl)acetic acid

CAS No.:

56763-07-6

Catalog Number:

AG01B26G

Molecular Formula:

C7H5ClN4O2

Molecular Weight:

212.5932

Catalog Number:

AG01B26G

Chemical Name:

2-(6-chloro-9H-purin-9-yl)acetic acid

CAS Number:

56763-07-6

Molecular Formula:

C7H5ClN4O2

Molecular Weight:

212.5932

MDL Number:

MFCD00847591

IUPAC Name:

2-(6-chloropurin-9-yl)acetic acid

InChI:

InChI=1S/C7H5ClN4O2/c8-6-5-7(10-2-9-6)12(3-11-5)1-4(13)14/h2-3H,1H2,(H,13,14)

InChI Key:

CNINCNIHGAUYEM-UHFFFAOYSA-N

SMILES:

OC(=O)Cn1cnc2c1ncnc2Cl

Complexity:

240

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

212.01g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

212.593g/mol

Monoisotopic Mass:

212.01g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

80.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.9