200,000+ products from a single source!
sales@angenechem.com
325491-53-0 | 4-Pyrimidineacetic acid
CAS No: 325491-53-0 Catalog No: AG00380Y MDL No:MFCD06796208
Product Description
Catalog Number:
AG00380Y
Chemical Name:
4-Pyrimidineacetic acid
CAS Number:
325491-53-0
Molecular Formula:
C6H6N2O2
Molecular Weight:
138.1240
MDL Number:
MFCD06796208
IUPAC Name:
2-pyrimidin-4-ylacetic acid
InChI:
InChI=1S/C6H6N2O2/c9-6(10)3-5-1-2-7-4-8-5/h1-2,4H,3H2,(H,9,10)
InChI Key:
INKXJLOOBMPRMB-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1ccncn1
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.043g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
138.126g/mol
Monoisotopic Mass:
138.043g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.