Name: Name:3-(2-nitrophenyl)-4,5-dihydro-1,2-oxazole-5-carboxylic acid
Brand: Angene
SKU: AG01A5KD
Rating: 90 (10 reviews)

3-(2-nitrophenyl)-4,5-dihydro-1,2-oxazole-5-carboxylic acid

CAS No.:

958891-04-8

Catalog Number:

AG01A5KD

Molecular Formula:

C10H8N2O5

Molecular Weight:

236.1809

Catalog Number:

AG01A5KD

Chemical Name:

3-(2-nitrophenyl)-4,5-dihydro-1,2-oxazole-5-carboxylic acid

CAS Number:

958891-04-8

Molecular Formula:

C10H8N2O5

Molecular Weight:

236.1809

MDL Number:

MFCD11203721

IUPAC Name:

3-(2-nitrophenyl)-4,5-dihydro-1,2-oxazole-5-carboxylic acid

InChI:

InChI=1S/C10H8N2O5/c13-10(14)9-5-7(11-17-9)6-3-1-2-4-8(6)12(15)16/h1-4,9H,5H2,(H,13,14)

InChI Key:

YNFNUXHAUWHDHQ-UHFFFAOYSA-N

SMILES:

OC(=O)C1ON=C(C1)c1ccccc1[N+](=O)[O-]

Complexity:

362

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

236.043g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

236.183g/mol

Monoisotopic Mass:

236.043g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

105A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2