Name: Name:3-Methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-carboxaldehyde, 97%
Brand: Angene
SKU: AG00DCO9
Rating: 90 (10 reviews)

3-Methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-carboxaldehyde, 97%

CAS No.:

54903-66-1

Catalog Number:

AG00DCO9

Molecular Formula:

C9H7NO3

Molecular Weight:

177.1568

Catalog Number:

AG00DCO9

Chemical Name:

3-Methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-carboxaldehyde, 97%

CAS Number:

54903-66-1

Molecular Formula:

C9H7NO3

Molecular Weight:

177.1568

MDL Number:

MFCD17171428

IUPAC Name:

3-methyl-2-oxo-1,3-benzoxazole-6-carbaldehyde

InChI:

InChI=1S/C9H7NO3/c1-10-7-3-2-6(5-11)4-8(7)13-9(10)12/h2-5H,1H3

InChI Key:

VNHQFRPZBXFNTO-UHFFFAOYSA-N

SMILES:

O=Cc1ccc2c(c1)oc(=O)n2C

Complexity:

241

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

177.043g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

177.159g/mol

Monoisotopic Mass:

177.043g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8