3,4-Dimethylaniline hydrochloride

CAT: 0127-OR1052144-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1052144-01Size:250 mg

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CAS Number

7356-54-9

MDL Number

MFCD25966771

Purity

95%

Smiles

NC1=CC=C(C)C(C)=C1.[H]Cl

Chemical Information

3,4-Dimethylaniline hydrochloride

CAS Number	7356-54-9
PubChem CID	12232011
IUPAC Name	3,4-dimethylaniline;hydrochloride
Molecular Formula	C8H12ClN
Molecular Weight	157.64
Topological Polar Surface Area	26
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Heavy Atom Count	10
Formal Charge	0
Complexity	90

SMILES

CC1=C(C=C(C=C1)N)C.Cl

InChI

InChI=1S/C8H11N.ClH/c1-6-3-4-8(9)5-7(6)2;/h3-5H,9H2,1-2H3;1H

InChIKey

OYZCOOMMDVDZNW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 7356-54-9

CID: 12232011

Formula: C8H12ClN

MW: 157.64

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	157.64
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	157.0658271
Monoisotopic Mass	157.0658271
Topological Polar Surface Area	26 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	90.6
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
OR17105	4-Bromo-2,3-dimethylaniline hydrochloride
OR80396-01	2,4-Dimethylaniline hydrochloride
OR1040416-01	4-Methoxy-2,3-dimethylaniline hydrochloride
OR909214-01	3-Chloro-N,4-dimethylaniline hydrochloride
OR921368-01	2,3-Dimethylaniline hydrochloride
OR1954-01	3,4-Dimethylaniline
OR1062464	4-Chloro-2,6-dimethylaniline hydrochloride
OR72719	4-Iodo-2,6-dimethylaniline hydrochloride
OR925208-01	3-Chloro-2,6-dimethylaniline hydrochloride
OR59371	3-Chloro-N,2-dimethylaniline hydrochloride

Catalog	Name
WAA43696-01	2,4-Dimethylaniline Hydrochloride
MXB38624	3-bromo-N,4-dimethylaniline hydrochloride
D37260-01	2 3-Dimethylaniline hydrochloride
sc-484743	2,3-Dimethylaniline Hydrochloride
DXC59156-01	4- (3-Aminophenyl) -N, N-dimethylaniline hydrochloride
TRC-A629563-100MG	4-(3-Aminopropyl)-N,N-dimethylaniline Hydrochloride
BAA70347-01	4- (Chloromethyl) -N, N-dimethylaniline hydrochloride
sc-355649	N-ethyl-2,4-dimethylaniline hydrochloride
sc-277221	4-Chloro-2,6-dimethylaniline hydrochloride
JBD31424-01	2-Fluoro-N,4-dimethylaniline hydrochloride