4-Chloro-3,5-dimethylaniline

CAT: 0127-OR1037558-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1037558-01Size:250 mg

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CAS Number

51719-61-0

MDL Number

MFCD20694378

Purity

98%

Smiles

CC1=CC(N)=CC(C)=C1Cl

Chemical Information

4-Chloro-3,5-dimethylaniline

CAS Number	51719-61-0
PubChem CID	12383114
IUPAC Name	4-chloro-3,5-dimethylaniline
Molecular Formula	C8H10ClN
Molecular Weight	155.62
XLogP	2.6
Topological Polar Surface Area	26
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Heavy Atom Count	10
Formal Charge	0
Complexity	104

SMILES

CC1=CC(=CC(=C1Cl)C)N

InChI

InChI=1S/C8H10ClN/c1-5-3-7(10)4-6(2)8(5)9/h3-4H,10H2,1-2H3

InChIKey

MSICOAYELJUIIN-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 51719-61-0

CID: 12383114

Formula: C8H10ClN

MW: 155.62

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	155.62
XLogP3	2.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	155.0501770
Monoisotopic Mass	155.0501770
Topological Polar Surface Area	26 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	104
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
OR1093526-01	5-chloro-2,4-dimethylaniline
OR941440-01	2-Chloro-4,5-dimethylaniline
OR480249-01	4-Chloro-2,5-dimethylaniline
OR90694-01	3-Chloro-2,4-dimethylaniline
OR1070046-01	4-Chloro-N,3-dimethylaniline
OR1099728-01	4-chloro-2,3-dimethylaniline
OR73214-01	3-Chloro-N,4-dimethylaniline
OR909214-01	3-Chloro-N,4-dimethylaniline hydrochloride
OR73195-01	4-Bromo-3,5-dimethylaniline
PC302214-01	4-Fluoro-3,5-dimethylaniline

Catalog	Name
BCA71961-01	4-chloro-3,5-dimethylaniline
BAA58513-01	2-Chloro-4,5-dimethylaniline
UCA38361-01	5-Chloro-2,4-dimethylaniline
sc-267376	4-Chloro-2,5-dimethylaniline
RBA45655	3-Chloro-N,4-dimethylaniline
CCA82769-01	2-Chloro-3,4-dimethylaniline
425132-01	3-Chloro-N,4-dimethylaniline, HCl
sc-330722	N-[2- (4-Chloro-3,5-dimethylphenoxy) ethyl]-3,4-dimethylaniline
TRC-F591200-10G	4-Fluoro-3,5-dimethylaniline
RBA45654	5-Chloro-N,2-dimethylaniline