AG0010JG

132312-93-7 | Benzenemethanamine, α-2-propen-1-yl-, hydrochloride (1:1), (αR)-

AG0010JG

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CAS Number	132312-93-7
Catalog Number	AG0010JG(AGN-PC-0WAM8X)
Chemical Name	Benzenemethanamine, α-2-propen-1-yl-, hydrochloride (1:1), (αR)-
IUPAC Name	(1R)-1-phenylbut-3-en-1-amine;hydrochloride
InChI	InChI=1S/C10H13N.ClH/c1-2-6-10(11)9-7-4-3-5-8-9;/h2-5,7-8,10H,1,6,11H2;1H/t10-;/m1./s1
InChI Key	FRNZDHMKEKWBTM-HNCPQSOCSA-N
MDL Number	MFCD22123873
Molecular Formula	C10H14ClN
Molecular Weight	183.6779
SMILES	C=CC[C@H](C1=CC=CC=C1)N.[H]Cl
Synonyms	(R)-1-Phenylbut-3-en-1-amine hydrochloride, 132312-93-7, (R)-1-Phenylbut-3-en-1-amine HCl, AK172643, KS-00000SZP, MFCD22123873, AKOS025395707, DS-8119, (1R)-1-Phenylbut-3-en-1-amine HCl, AX8297094, Benzenemethanamine, alpha-2-propen-1-yl-, hydrochloride (1:1), (alphaR)-, 115224-13-0,

Complexity	114
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	183.081g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	183.679g/mol
Monoisotopic Mass	183.081g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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