AG0035A5

56038-89-2 | N-(1-Ethylpropyl)-3,4-dimethylaniline

AG0035A5

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CAS Number	56038-89-2
Catalog Number	AG0035A5(AGN-PC-0JLZG3)
Chemical Name	N-(1-Ethylpropyl)-3,4-dimethylaniline
EC Number	611-347-8
IUPAC Name	3,4-dimethyl-N-pentan-3-ylaniline
InChI	InChI=1S/C13H21N/c1-5-12(6-2)14-13-8-7-10(3)11(4)9-13/h7-9,12,14H,5-6H2,1-4H3
InChI Key	ZOTRFGNOTDLOAU-UHFFFAOYSA-N
MDL Number	MFCD05662422
Molecular Formula	C13H21N
Molecular Weight	191.3125
SMILES	CCC(Nc1ccc(c(c1)C)C)CC
UNII	L2PBQ2GDBJ
Synonyms	56038-89-2, N-(1-ethylpropyl)-3,4-dimethylaniline, 3,4-dimethyl-N-(pentan-3-yl)aniline, N-(1-Ethylpropyl)-3,4-Xylidine, UNII-L2PBQ2GDBJ, Benzenamine, N-(1-ethylpropyl)-3,4-dimethyl-, L2PBQ2GDBJ, Benzenamine, N-(1-ethylpropyl)-4,5-dimethyl-, 3,4-dimethyl-N-pentan-3-ylaniline, N-(1-ethylpropyl)-3,4-dimethylBenzenamine, AC1Q2SFW, ACMC-1AU3R, DSSTox_CID_8040, AC1L3N6V, N-3-pentyl-3,4-xylidine, DSSTox_RID_78647, DSSTox_GSID_28040, SCHEMBL7521514, CHEMBL3184416, DTXSID4028040, CTK5A4540, ZOTRFGNOTDLOAU-UHFFFAOYSA-N, ZINC2546115, Tox21_301810, MFCD05662422, N-(1-ethyl propyl)-3,4-xylidiene, AKOS000235589, MCULE-3918741506, NE24464, KS-000001R0, NCGC00255392-01, AN-40264, CJ-09279, N-(1-ethylpropyl)-3,4-dimethyl-aniline, CAS-56038-89-2, DB-072087, LS-195528, FT-0714993, N-(1-ethylpropyl)-3,4-dimethyl-benzenamine, Benzenamine,N-(1-ethylpropyl)-3,4-dimethyl-, EN300-55448, 038D892, N-(1-Ethylpropyl)-3,4-dimethylaniline, N-(1-Ethylpropyl)-3,4-xylidine, N-(1-Ethylpropyl)-3,4-dimethylaniline,N-(1-Ethylpropyl)-3,4-xylidine, CID91984, 1,6-Dichloro-1,6-dideoxy-beta-D-fructofuranosyl 4-chloro-4-deoxy-alpha-D-galactose,

Complexity	151
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	191.167g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	191.318g/mol
Monoisotopic Mass	191.167g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	12A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P280-P305+P351+P338-P310
UN Code

Certificate of Analysis

Lot Number