AG003BCK

71581-92-5 | ((1R,2S)-2-(Benzylamino)cyclohexyl)methanol

AG003BCK

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CAS Number	71581-92-5
Catalog Number	AG003BCK(AGN-PC-0OH0DS)
Chemical Name	((1R,2S)-2-(Benzylamino)cyclohexyl)methanol
IUPAC Name	[(1R,2S)-2-(benzylamino)cyclohexyl]methanol
InChI	InChI=1S/C14H21NO/c16-11-13-8-4-5-9-14(13)15-10-12-6-2-1-3-7-12/h1-3,6-7,13-16H,4-5,8-11H2/t13-,14-/m0/s1
InChI Key	BRQFIORUNWWNBM-KBPBESRZSA-N
MDL Number	MFCD00151395
Molecular Formula	C14H21NO
Molecular Weight	219.3226
SMILES	OC[C@H]1[C@@H](NCC2=CC=CC=C2)CCCC1
Synonyms	71581-92-5, (+)-cis-2-Benzylaminocyclohexanemethanol, ((1R,2S)-2-(Benzylamino)cyclohexyl)methanol, cis-(1R,2S)-(+)-2-(Benzylamino)cyclohexanemethanol, [(1R,2S)-2-(benzylamino)cyclohexyl]methanol, BRQFIORUNWWNBM-KBPBESRZSA-N, CIS-(1R,2S)-(+)-2-BENZYLAMINOCYCLOHEXANEMETHANOL, (-)-cis-2-Benzylaminocyclohexanemethanol, 77647-26-8, 71581-93-6, (1R,2S)-(+)-cis-2-(Benzylamino)cyclohexanemethanol, 99%, 99% e.e., PubChem7939, AC1LGY00, AC1Q77QO, AC1Q77QP, SCHEMBL249580, CTK2I0914, DTXSID30357478, ZINC395563, KS-000011TL, ANW-36067, cis-2-(benzylamino)cyclohexylmethanol, MFCD00151395, AKOS015839214, [2-(Benzylamino)cyclohexyl]methanol #, FCH3444221, AJ-21518, AS-40714, AX8043070, TR-023529, FT-0604542, 2beta-(Benzylamino)cyclohexane-1beta-methanol, (1S,2R)-(-)-2-benzylaminocyclohexanemethanol, (+)-N-Benzyl-cis-2-hydroxymethylcyclohexylamine, (+)-Benzyl(cis-2-[hydroxymethyl]cyclohexyl)amine, (+-)-cis-N-Benzyl-2-(hydroxymethyl)cyclohexylamin, cis-(1R,2S)-()-2-(Benzylamino)cyclohexanemethanol, J-500403, (+/-)-cis-N-Benzyl-2-(hydroxymethyl)cyclohexylamine, (+)-Dehydroabietylamine, [2-(Benzylamino)cyclohexyl]methanol, CID853687, CB10499, CB10500, CB10503, B1119, 99306-87-3,

Complexity	189
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	219.162g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	219.328g/mol
Monoisotopic Mass	219.162g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	32.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319
Packing Group
Precautionary statements	P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
UN Code

Certificate of Analysis

Lot Number