Name: Name:5-(methoxymethyl)-1-phenyl-1H-pyrazole-4-carboxylic acid
Brand: Angene
SKU: AG01ACL8
Rating: 90 (10 reviews)

5-(methoxymethyl)-1-phenyl-1H-pyrazole-4-carboxylic acid

CAS No.:

130187-94-9

Catalog Number:

AG01ACL8

Molecular Formula:

C12H12N2O3

Molecular Weight:

232.2353

Catalog Number:

AG01ACL8

Chemical Name:

5-(methoxymethyl)-1-phenyl-1H-pyrazole-4-carboxylic acid

CAS Number:

130187-94-9

Molecular Formula:

C12H12N2O3

Molecular Weight:

232.2353

MDL Number:

MFCD22022600

IUPAC Name:

5-(methoxymethyl)-1-phenylpyrazole-4-carboxylic acid

InChI:

InChI=1S/C12H12N2O3/c1-17-8-11-10(12(15)16)7-13-14(11)9-5-3-2-4-6-9/h2-7H,8H2,1H3,(H,15,16)

InChI Key:

WXNJBHPFRNTEEX-UHFFFAOYSA-N

SMILES:

COCc1c(cnn1c1ccccc1)C(=O)O

Complexity:

267

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

232.085g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

232.239g/mol

Monoisotopic Mass:

232.085g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

64.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1