AG0070LE

136624-42-5 | 4-Amino-1-benzylpiperidine-4-carbonitrile

AG0070LE

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CAS Number	136624-42-5
Catalog Number	AG0070LE(AGN-PC-0N8Q15)
Chemical Name	4-Amino-1-benzylpiperidine-4-carbonitrile
IUPAC Name	4-amino-1-benzylpiperidine-4-carbonitrile
InChI	InChI=1S/C13H17N3/c14-11-13(15)6-8-16(9-7-13)10-12-4-2-1-3-5-12/h1-5H,6-10,15H2
InChI Key	GKFZBGLUEBXSBF-UHFFFAOYSA-N
MDL Number	MFCD09042612
Molecular Formula	C13H17N3
Molecular Weight	215.2942
SMILES	N#CC1(N)CCN(CC2=CC=CC=C2)CC1
Synonyms	4-amino-1-benzylpiperidine-4-carbonitrile, 136624-42-5, 4-amino-1-benzyl-piperidine-4-carbonitrile, AK-58601, ACMC-20aqh5, SCHEMBL1587072, CTK0G9907, KS-00000NWT, DTXSID20443415, GKFZBGLUEBXSBF-UHFFFAOYSA-N, ACT08351, MFCD09042612, ZINC21953475, AKOS000126832, BBV-006204, FCH4769353, MB06905, RTC-066326, AJ-78785, AB0000830, AX8093539, DB-063156, ST2401875, TC-066326, 4CH-019635, FT-0652126, X9952, EN300-97232, B-2106, 4-amino-1-(phenylmethyl)-4-piperidinecarbonitrile, A807103, 4-azanyl-1-(phenylmethyl)piperidine-4-carbonitrile, I12-0296, C13H17N3, CID10680206, 6094-60-6,

Complexity	264
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	215.142g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	215.3g/mol
Monoisotopic Mass	215.142g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	53A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.9

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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