CAS 87963-75-5 | Benzamide, 2-formyl- | CAS Number 87963-75-5

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87963-75-5 | Benzamide, 2-formyl-

CAS No: 87963-75-5 Catalog No: AG004G9F MDL No:MFCD18824519

Product Description

Catalog Number:

AG004G9F

Chemical Name:

Benzamide, 2-formyl-

CAS Number:

87963-75-5

Molecular Formula:

C8H7NO2

Molecular Weight:

149.1467

MDL Number:

MFCD18824519

IUPAC Name:

2-formylbenzamide

InChI:

InChI=1S/C8H7NO2/c9-8(11)7-4-2-1-3-6(7)5-10/h1-5H,(H2,9,11)

InChI Key:

BIZCBYJEVMKIDD-UHFFFAOYSA-N

SMILES:

O=Cc1ccccc1C(=O)N

Properties

Complexity:

168

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

149.048g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

149.149g/mol

Monoisotopic Mass:

149.048g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

60.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.5

Literature

Title	Journal
(E)-4-methoxybenzaldehyde O-(N-phenylcarbamoyl)oxime.	Acta crystallographica. Section C, Crystal structure communications 20050701
Di-n-butyltin(IV) complexes derived from heterocyclic beta-diketones and N-phthaloyl amino acids: preparation, biological evaluation, structural elucidation based upon spectral [IR, NMR (1H, 13C, 19F and 119Sn)] studies.	Bioinorganic chemistry and applications 20050101
Highly efficient stereoconservative amidation and deamidation of alpha-amino acids.	Organic letters 20041014