Name: Name:1-benzyl-3-(2-methoxyphenyl)-1H-pyrazole-4-carboxylic acid
Brand: Angene
SKU: AG00IJ9W
Rating: 90 (10 reviews)

1-benzyl-3-(2-methoxyphenyl)-1H-pyrazole-4-carboxylic acid

CAS No.:

956354-20-4

Catalog Number:

AG00IJ9W

Molecular Formula:

C18H16N2O3

Molecular Weight:

308.3312

Catalog Number:

AG00IJ9W

Chemical Name:

1-benzyl-3-(2-methoxyphenyl)-1H-pyrazole-4-carboxylic acid

CAS Number:

956354-20-4

Molecular Formula:

C18H16N2O3

Molecular Weight:

308.3312

MDL Number:

MFCD06378219

IUPAC Name:

1-benzyl-3-(2-methoxyphenyl)pyrazole-4-carboxylic acid

InChI:

InChI=1S/C18H16N2O3/c1-23-16-10-6-5-9-14(16)17-15(18(21)22)12-20(19-17)11-13-7-3-2-4-8-13/h2-10,12H,11H2,1H3,(H,21,22)

InChI Key:

VNWXVSPXKCCXQN-UHFFFAOYSA-N

SMILES:

COc1ccccc1c1nn(cc1C(=O)O)Cc1ccccc1

Complexity:

398

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

308.116g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

308.337g/mol

Monoisotopic Mass:

308.116g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

64.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3: