200,000+ products from a single source!
sales@angenechem.com
933702-12-6 | 6-Chloro-5-methylpyrimidine-4-carboxylic acid
CAS No: 933702-12-6 Catalog No: AG006G7Q MDL No:MFCD17215887
Product Description
Catalog Number:
AG006G7Q
Chemical Name:
6-Chloro-5-methylpyrimidine-4-carboxylic acid
CAS Number:
933702-12-6
Molecular Formula:
C6H5ClN2O2
Molecular Weight:
172.5691
MDL Number:
MFCD17215887
IUPAC Name:
6-chloro-5-methylpyrimidine-4-carboxylic acid
InChI:
InChI=1S/C6H5ClN2O2/c1-3-4(6(10)11)8-2-9-5(3)7/h2H,1H3,(H,10,11)
InChI Key:
SXZYXDFPPBBYPH-UHFFFAOYSA-N
SMILES:
OC(=O)c1ncnc(c1C)Cl
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.004g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
172.568g/mol
Monoisotopic Mass:
172.004g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.