2-Nitrobenzaldehyde

CAT: 1596-AR-N07968-01Size: 10 UnitsDry Ice: NoHazardous: No

1 / 1

CAT#:1596-AR-N07968-01Size:10 Units

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

552-89-6

Synonyms

O-Nitrobenzaldehyde; 1-Formyl-2-nitrobenzene; 2-Formyl-3-nitrobenzene; NSC 5713; 2-Nitrobenzenecarboxaldehyde; 2-NBA

Molecular Formula

C7H5NO3

Molecular Weight

151.12

API Name

Miscellaneous

Chemical Information

2-Nitrobenzaldehyde

2-nitrobenzaldehyde is benzaldehyde substituted at the ortho-position with a nitro group. It is a member of benzaldehydes and a C-nitro compound.

CAS Number	552-89-6
PubChem CID	11101
IUPAC Name	2-nitrobenzaldehyde
Molecular Formula	C7H5NO3
Molecular Weight	151.12
XLogP	1.7
Topological Polar Surface Area	62.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	11
Formal Charge	0
Complexity	164

SMILES

C1=CC=C(C(=C1)C=O)[N+](=O)[O-]

InChI

InChI=1S/C7H5NO3/c9-5-6-3-1-2-4-7(6)8(10)11/h1-5H

InChIKey

CMWKITSNTDAEDT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 552-89-6

CID: 11101

Formula: C7H5NO3

MW: 151.12

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	151.12
XLogP3	1.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	151.026943022
Monoisotopic Mass	151.026943022
Topological Polar Surface Area	62.9 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	164
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
AR-N01883-01	3-Nitrobenzaldehyde
AR-B06674-01	2,2,2-Trifluoroethyl 2,5-Bis (2,2,2-trifluoroethoxy) Benzoate
AR-M03112	2,2,2-Trichloroethanol
AR-S09242-01	2-[2- (2,2,2-Trifluoroethoxy) phenoxy]ethyl Methanesulfonate
AR-V01805-01	2- (2- (2-fluorophenyl) -2-oxoethyl) malononitrile
AR-P32875-01	2- (2-Naphthyl) -2-Propanol
AR-C07166-01	2,2,2-Trichloroethyl Chloroformate
AR-A01250-01	2,2-Dimethoxy-2-Phenylacetophenone
AR-P01078-01	(Z) -methyl 2- (2,2-dimethoxyethyl) but-2-enoate
AR-B07347-01	5,5'-Dinitro-2,2'-2,2'-Biphenyldiol

Catalog	Name
FN37099-01	2-Nitrobenzaldehyde
TRC-N492150-2.5G	2-Nitrobenzaldehyde Semicarbazone
sc-230592A	2-Nitrobenzaldehyde tosylhydrazone
114680 1	2-Nitrobenzaldehyde AR
HY-W698891-01	2-Nitrobenzaldehyde-d4
LC-10190.1	2-Nitrobenzaldehyde for synthesis