AG003BIP

216394-07-9 | (1S,2S)-2-(Benzyloxy)cyclohexanamine

AG003BIP

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CAS Number	216394-07-9
Catalog Number	AG003BIP(AGN-PC-0O7VY5)
Chemical Name	(1S,2S)-2-(Benzyloxy)cyclohexanamine
IUPAC Name	(1S,2S)-2-phenylmethoxycyclohexan-1-amine
InChI	InChI=1S/C13H19NO/c14-12-8-4-5-9-13(12)15-10-11-6-2-1-3-7-11/h1-3,6-7,12-13H,4-5,8-10,14H2/t12-,13-/m0/s1
InChI Key	NTHNRYLIXJZHRZ-STQMWFEESA-N
MDL Number	MFCD01075753
Molecular Formula	C13H19NO
Molecular Weight	205.2961
SMILES	O(C1(C(N)CCCC1))CC2(=CC=CC=C2)
Synonyms	216394-07-9, (1S,2S)-2-(Benzyloxy)cyclohexanamine, (1S,2S)-(+)-2-Benzyloxycyclohexylamine, (1s,2s)-2-benzyloxycyclohexylamine, MFCD01075753, (1S,2S)-2-(benzyloxy)cyclohexan-1-amine, (1S,2S)-2-phenylmethoxycyclohexan-1-amine, (1S,2S)-trans-2-Benzyloxy-cyclohexylamine, (1S,2S)-(+)-1-Amino-2-benzyloxycyclohexane, AK-81448, SCHEMBL354312, CTK8B7506, DTXSID10474551, NTHNRYLIXJZHRZ-STQMWFEESA-N, ZINC5239780, ANW-57502, CB-669, (1S,2S)-2-benzyloxy-cyclohexylamine, (1S, 2S)-2-benzyloxy-cyclohexylamine, (1S,2S)-2-(benzyloxy)cyclohexylamine, AM62760, FCH1684473, FS-3601, (1S,2S)-1-Amino-2-benzyloxycyclohexane, AJ-53693, BC679653, (1S,2S)-trans-2-Benzyloxycyclohexylamine, AB0009877, AX8043825, RT-005318, ST2414098, (1S)-trans-2-(Phenylmethoxy)cyclohexanamine, CS-0077159, FT-0604564, M-3919, (1S)-1alpha-Amino-2beta-(benzyloxy)cyclohexane, (1S,2S)-trans-2-Benzyloxycyclohexylamine, 96%, (1S,2S)-(+)-2-BENZYLOXY CYCLOHEXYLAMINE, 394B079, Cyclohexanamine, 2-(phenylmethoxy)-, (1S,2S)-, (1S,2S)-(+)-2-Benzyloxycyclohexylamine, ChiPros, (1S-trans)-2-(Phenylmethoxy) cyclohexaminetaneamine, I14-5928, J-014199, (1S,2S)-trans-2-Benzyloxycyclohexylamine, ChiPros(R), produced by BASF, 99%, - -2-Benzyloxycyclohexylamine, C13H19NO, 2-phenylmethoxycyclohexan-1-amine, CID11908838, 216394-06-8,

Complexity	177
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	205.147g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	205.301g/mol
Monoisotopic Mass	205.147g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	35.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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