AG003APR

72954-91-7 | 1-(4-Chlorophenyl)-2-methylpropan-1-amine hydrochloride

AG003APR

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CAS Number	72954-91-7
Catalog Number	AG003APR(AGN-PC-0BIMH8)
Chemical Name	1-(4-Chlorophenyl)-2-methylpropan-1-amine hydrochloride
IUPAC Name	1-(4-chlorophenyl)-2-methylpropan-1-amine;hydrochloride
InChI	InChI=1S/C10H14ClN.ClH/c1-7(2)10(12)8-3-5-9(11)6-4-8;/h3-7,10H,12H2,1-2H3;1H
InChI Key	VCBGQWZZQKYLLK-UHFFFAOYSA-N
MDL Number	MFCD28126643
Molecular Formula	C10H15Cl2N
Molecular Weight	220.1388
SMILES	Cl.ClC1=CC=C(C=C1)C(C(C)C)N
Synonyms	1-(4-chlorophenyl)-2-methylpropan-1-amine hydrochloride, 72954-91-7, SCHEMBL1695432, MFCD28126643, AKOS026747814, DS-20256, AK00739011, F2167-2196,

Complexity	128
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	219.058g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	220.137g/mol
Monoisotopic Mass	219.058g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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