200,000+ products from a single source!
sales@angenechem.com
91138-00-0 | 5-METHYL-1-PHENYL-1H-PYRAZOLE-4-CARBOXYLIC ACID
CAS No: 91138-00-0 Catalog No: AG003MUV MDL No:MFCD00067831
Product Description
Catalog Number:
AG003MUV
Chemical Name:
5-METHYL-1-PHENYL-1H-PYRAZOLE-4-CARBOXYLIC ACID
CAS Number:
91138-00-0
Molecular Formula:
C11H10N2O2
Molecular Weight:
202.2093
MDL Number:
MFCD00067831
IUPAC Name:
5-methyl-1-phenylpyrazole-4-carboxylic acid
InChI:
InChI=1S/C11H10N2O2/c1-8-10(11(14)15)7-12-13(8)9-5-3-2-4-6-9/h2-7H,1H3,(H,14,15)
InChI Key:
USSMIQWDLWJQDQ-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnn(c1C)c1ccccc1
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.074g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.213g/mol
Monoisotopic Mass:
202.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.