Name: Name:1H-Pyrazole-3-carboxylicacid,4-(hydroxymethyl)-,methylester(9CI)
Brand: Angene
SKU: AG00AHP5
Rating: 90 (10 reviews)

1H-Pyrazole-3-carboxylicacid,4-(hydroxymethyl)-,methylester(9CI)

CAS No.:

124598-39-6

Catalog Number:

AG00AHP5

Molecular Formula:

C6H8N2O3

Molecular Weight:

156.1393

Catalog Number:

AG00AHP5

Chemical Name:

1H-Pyrazole-3-carboxylicacid,4-(hydroxymethyl)-,methylester(9CI)

CAS Number:

124598-39-6

Molecular Formula:

C6H8N2O3

Molecular Weight:

156.1393

MDL Number:

MFCD13175004

IUPAC Name:

methyl 4-(hydroxymethyl)-1H-pyrazole-5-carboxylate

InChI:

InChI=1S/C6H8N2O3/c1-11-6(10)5-4(3-9)2-7-8-5/h2,9H,3H2,1H3,(H,7,8)

InChI Key:

HJTUQHAUIYTECK-UHFFFAOYSA-N

SMILES:

COC(=O)c1n[nH]cc1CO

Complexity:

151

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

156.053g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

156.141g/mol

Monoisotopic Mass:

156.053g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.5