200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1014632-18-8
1014632-18-8 | 1H-Pyrazole-4-carboxylic acid, 1-(2-pyrimidinyl)-
CAS No: 1014632-18-8 Catalog No: AG0004JF MDL No:MFCD12192706
Product Description
Catalog Number:
AG0004JF
Chemical Name:
1H-Pyrazole-4-carboxylic acid, 1-(2-pyrimidinyl)-
CAS Number:
1014632-18-8
Molecular Formula:
C8H6N4O2
Molecular Weight:
190.1588
MDL Number:
MFCD12192706
IUPAC Name:
1-pyrimidin-2-ylpyrazole-4-carboxylic acid
InChI:
InChI=1S/C8H6N4O2/c13-7(14)6-4-11-12(5-6)8-9-2-1-3-10-8/h1-5H,(H,13,14)
InChI Key:
IPLDZENGFJONBV-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnn(c1)c1ncccn1
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.049g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.162g/mol
Monoisotopic Mass:
190.049g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
80.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.