Name: Name:1H-Pyrazole-3-carboxylic acid, 5-(methoxymethyl)-, ethyl ester
Brand: Angene
SKU: AG000TMN
Rating: 90 (10 reviews)

1H-Pyrazole-3-carboxylic acid, 5-(methoxymethyl)-, ethyl ester

CAS No.:

1297546-22-5

Catalog Number:

AG000TMN

Molecular Formula:

C8H12N2O3

Molecular Weight:

184.1925

Catalog Number:

AG000TMN

Chemical Name:

1H-Pyrazole-3-carboxylic acid, 5-(methoxymethyl)-, ethyl ester

CAS Number:

1297546-22-5

Molecular Formula:

C8H12N2O3

Molecular Weight:

184.1925

MDL Number:

MFCD23105878

IUPAC Name:

ethyl 5-(methoxymethyl)-1H-pyrazole-3-carboxylate

InChI:

InChI=1S/C8H12N2O3/c1-3-13-8(11)7-4-6(5-12-2)9-10-7/h4H,3,5H2,1-2H3,(H,9,10)

InChI Key:

HAVGYLPMVBRFCV-UHFFFAOYSA-N

SMILES:

COCc1[nH]nc(c1)C(=O)OCC

Complexity:

175

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

184.085g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

184.195g/mol

Monoisotopic Mass:

184.085g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

64.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.5