AG00DB1M

5266-85-3 | 6-Isopropyl-o-toluidine

AG00DB1M

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CAS Number	5266-85-3
Catalog Number	AG00DB1M(AGN-PC-0JLRON)
Chemical Name	6-Isopropyl-o-toluidine
EC Number	226-083-5
IUPAC Name	2-methyl-6-propan-2-ylaniline
InChI	InChI=1S/C10H15N/c1-7(2)9-6-4-5-8(3)10(9)11/h4-7H,11H2,1-3H3
InChI Key	DDTKYVBFPULMGN-UHFFFAOYSA-N
MDL Number	MFCD00007746
Molecular Formula	C10H15N
Molecular Weight	149.2328
SMILES	CC(C)C1=C(N)C(C)=CC=C1
UNII	JS12FDL562
Synonyms	2-Isopropyl-6-methylaniline, 5266-85-3, 6-Isopropyl-o-toluidine, 2-Methyl-6-isopropylaniline, Benzenamine, 2-methyl-6-(1-methylethyl)-, UNII-JS12FDL562, 2-methyl-6-(propan-2-yl)aniline, JS12FDL562, 2-methyl-6-propan-2-ylaniline, DDTKYVBFPULMGN-UHFFFAOYSA-N, 6-methyl-2-(methylethyl)phenylamine, 2-isopropyl-6-methylbenzenamine, 2-Amino-m-cymene, EINECS 226-083-5, PubChem4031, 2-Amino-3-methylcumene, AC1Q1OUJ, 2-isopropyl-6-methylanilin, 2-Amino-3-isopropyltoluene, 2-iso-propyl-6-methylaniline, 2-isopropyl-6-methyl-aniline, 2-Methyl-6-isopropyl aniline, SCHEMBL399144, AC1L2W91, AC1Q539V, NIOSH/BY4205000, Aniline, 2-isopropyl-6-methyl-, CTK4J6282, 2-Isopropyl-6-methyl-phenylamine, DTXSID40200628, 2-Methyl-6-(prop-2-yl)aniline, 2-(1-methylethyl)-6-methylaniline, ZINC2166821, ANW-59477, BBL036472, CI-207, MFCD00007746, SBB004080, AKOS000120349, 2-Methyl-6-(1-methylethyl)benzenamine, AN-5783, CS-W020539, MCULE-9368691444, AJ-33792, AK-35491, CJ-33340, LS-19855, PS-11728, SC-05055, Benzenamine,2-methyl-6-(1-methylethyl)-, DB-006172, TC-148222, BY42050000, FT-0080674, FT-0600437, ST24040740, ST50213782, Z2358, L-1168, 266I853, I01-7075, InChI=1/C10H15N/c1-7(2)9-6-4-5-8(3)10(9)11/h4-7H,11H2,1-3H, C10H15N, CID78920, AR-1E2950, C10-H15-N, ACN-051721, BY4205000, 5375-49-5,

Complexity	120
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	149.12g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	149.237g/mol
Monoisotopic Mass	149.12g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H226-H302-H315-H319
Packing Group	Ⅲ
Precautionary statements	P305+P351+P338
UN Code	UN 1993

Certificate of Analysis

Lot Number