2-Nitroaniline Hydrochloride

CAT: 0127-OR1030272-01Size: 5 gDry Ice: NoHazardous: No

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CAT#:0127-OR1030272-01Size:5 g

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CAS Number

15873-52-6

Synonyms

2-nitroaniline; hydrochloride

Purity

98%

Smiles

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

Chemical Information

2-Nitroaniline Hydrochloride

CAS Number	15873-52-6
PubChem CID	15621111
IUPAC Name	2-nitroaniline;hydrochloride
Molecular Formula	C6H7ClN2O2
Molecular Weight	174.58
Topological Polar Surface Area	71.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Heavy Atom Count	11
Formal Charge	0
Complexity	132

SMILES

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

InChI

InChI=1S/C6H6N2O2.ClH/c7-5-3-1-2-4-6(5)8(9)10;/h1-4H,7H2;1H

InChIKey

RVOCTLMBKVTNFR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 15873-52-6

CID: 15621111

Formula: C6H7ClN2O2

MW: 174.58

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	174.58
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	174.0196052
Monoisotopic Mass	174.0196052
Topological Polar Surface Area	71.8 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	132
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	2
Compound Is Canonicalized	Yes

Catalog	Name
OR85727-01	2-Chloro-3-nitroaniline hydrochloride
OR95248-01	3-Nitroaniline hydrochloride
OR80784-01	4-Nitroaniline hydrochloride
OR322158-01	2-Nitroaniline
OR6670-01	N-Benzyl-2-nitroaniline
OR1055359-01	2-Ethyl-4-nitroaniline
PC1002262-01	4- (Difluoromethyl) -2-nitroaniline
OR1032199-01	2-Isopropoxy-4-nitroaniline
OR2118-01	2-Bromo-4-nitroaniline
PC3870-01	4-Fluoro-2-nitroaniline

Catalog	Name
sc-485719	2-Nitroaniline Hydrochloride
DXC61071-01	2-Bromo-3-nitroaniline hydrochloride
DXC59009	2-Chloro-3-nitroaniline hydrochloride
sc-342940	2-methoxy-5-nitroaniline hydrochloride
LDA41971	N- (2-Aminoethyl) -2-nitroaniline hydrochloride
QAA87351-01	4-Nitroaniline Hydrochloride
sc-485720	3-Nitroaniline Hydrochloride
N06360-01	P-Nitroaniline hydrochloride
sc-354493	N- (3-aminopropyl) -2-nitroaniline hydrochloride
XLD03013-01	3-Iodo-5-nitroaniline hydrochloride