N-Ethyl-3,4-dimethylaniline

CAT: 0127-OR1045332-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1045332-01Size:100 mg

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CAS Number

27285-20-7

MDL Number

MFCD03210677

Purity

95%

Smiles

CC1=CC=C(C=C1C)NCC

Chemical Information

N-Ethyl-3,4-dimethylaniline

CAS Number	27285-20-7
PubChem CID	21480163
IUPAC Name	N-ethyl-3,4-dimethylaniline
Molecular Formula	C10H15N
Molecular Weight	149.23
XLogP	3.5
Topological Polar Surface Area	12
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	111

SMILES

CCNC1=CC(=C(C=C1)C)C

InChI

InChI=1S/C10H15N/c1-4-11-10-6-5-8(2)9(3)7-10/h5-7,11H,4H2,1-3H3

InChIKey

QEMSZFCUTKHUMD-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 27285-20-7

CID: 21480163

Formula: C10H15N

MW: 149.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	149.23
XLogP3	3.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	149.120449483
Monoisotopic Mass	149.120449483
Topological Polar Surface Area	12 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	111
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
OR1070046-01	4-Chloro-N,3-dimethylaniline
OR1038838-01	4-Bromo-n,3-dimethylaniline
PC103378-01	4-Fluoro-N,3-dimethylaniline
PC1006108-01	3,4-Difluoro-N, N-dimethylaniline
OR1049406-01	4- (3-Aminopropyl) -N, N-dimethylaniline
OR73214-01	3-Chloro-N,4-dimethylaniline
OR80628-01	N,3-Dimethylaniline
OR1061844-01	4,4'-Methylenebis (3-bromo-N, N-dimethylaniline)
OR13074	3-Iodo-4-nitro-N, N-dimethylaniline
OR1954-01	3,4-Dimethylaniline

Catalog	Name
sc-295708	N-ethyl-3,4-dimethylaniline
sc-355648A	N-ethyl-2,4-dimethylaniline
sc-331304	N-Ethyl-3,5-dimethylaniline
sc-355649	N-ethyl-2,4-dimethylaniline hydrochloride
sc-330632	N-[2- (2,4-Dichlorophenoxy) ethyl]-3,4-dimethylaniline
sc-330674	N-[2- (3,4-Dimethylphenoxy) ethyl]-2,3-dimethylaniline
sc-355654	N-ethyl-3,5-dimethylaniline hydrochloride
sc-330729	N-[2- (4-Chlorophenoxy) ethyl]-2,4-dimethylaniline
sc-330722	N-[2- (4-Chloro-3,5-dimethylphenoxy) ethyl]-3,4-dimethylaniline
sc-330712	N-[2- (4-Chloro-3-methylphenoxy) ethyl]-2,3-dimethylaniline