AG001Y2D

168466-85-1 | 3-Piperidinamine, 1-(phenylmethyl)-, (3S)-

AG001Y2D

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CAS Number	168466-85-1
Catalog Number	AG001Y2D(AGN-PC-0O4RXC)
Chemical Name	3-Piperidinamine, 1-(phenylmethyl)-, (3S)-
IUPAC Name	(3S)-1-benzylpiperidin-3-amine
InChI	InChI=1S/C12H18N2/c13-12-7-4-8-14(10-12)9-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10,13H2/t12-/m0/s1
InChI Key	HARWNWOLWMTQCC-LBPRGKRZSA-N
MDL Number	MFCD03093375
Molecular Formula	C12H18N2
Molecular Weight	190.2847
SMILES	C(C1=CC=CC=C1)N1C[C@H](CCC1)N
Synonyms	168466-85-1, (S)-1-benzylpiperidin-3-amine, (S)-1-BENZYL-3-AMINOPIPERIDINE, (S)-3-Amino-1-benzylpiperidine, (3S)-1-benzylpiperidin-3-amine, (S)-3-Amino-1-benzyl-piperidine, 3-PIPERIDINAMINE, 1-(PHENYLMETHYL)-, (3S)-, MFCD03093375, (S)-3-amino- N-Benzylpiperidine, (S)-N-Benzyl-3-amino-piperidine, PubChem11490, AC1LGZ0I, SCHEMBL3023682, CTK4D3002, KS-00000ZHK, DTXSID80357549, HARWNWOLWMTQCC-LBPRGKRZSA-N, ACT09088, ANW-22347, ZINC95082140, AKOS000278314, AB13234, AC-9110, AN-7367, AS06665, CB-3205, EBD2219687, PS-3858, RP25007, RTC-070483, (3S)-1-(Phenylmethyl)-3-piperidinamine, AJ-85351, AM807342, BR-44566, AB0005393, DB-011757, ST2414540, TC-070483, (S)-1-benzyl-3-aminopiperidine, AldrichCPR, FT-0655944, W3671, 3-Piperidinamine,1-(phenylmethyl)-, (3S)-, A-1983, 532B021, AS-813/43368135, I14-3752, Q-102974, 1-Benzyl-piperidin-3-ylamine, (S)-3-Amino-1-benzyl-piperdine, 1-BENZYL-3-PIPERIDINAMINE, C12H18N2, CID854131, NSC137967, ACN-031083, 307532-02-1, (S)-1-Benzyl-3-aminopiperidine, 98%, ee: 98% - 1G 1g,

Complexity	164
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	190.147g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	190.29g/mol
Monoisotopic Mass	190.147g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	29.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

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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