AG002BQ3

19878-18-3 | Cyclohexanecarboxylic acid, 4-(aminomethyl)-, ethyl ester, hydrochloride (1:1), trans-

AG002BQ3

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CAS Number	19878-18-3
Catalog Number	AG002BQ3(AGN-PC-0QQ3Q6)
Chemical Name	Cyclohexanecarboxylic acid, 4-(aminomethyl)-, ethyl ester, hydrochloride (1:1), trans-
IUPAC Name	ethyl 4-(aminomethyl)cyclohexane-1-carboxylate;hydrochloride
InChI	InChI=1S/C10H19NO2.ClH/c1-2-13-10(12)9-5-3-8(7-11)4-6-9;/h8-9H,2-7,11H2,1H3;1H
InChI Key	ZGOGVHCRASZRFV-UHFFFAOYSA-N
MDL Number	MFCD28134591
Molecular Formula	C10H20ClNO2
Molecular Weight	221.7243
SMILES	O=C([C@H]1CC[C@H](CN)CC1)OCC.[H]Cl
Synonyms	19878-18-3, trans-Ethyl 4-(aminomethyl)cyclohexanecarboxylate hydrochloride, Ethyl 4-(aminomethyl)cyclohexanecarboxylate hydrochloride, 1191414-21-7, cis-Ethyl 4-(aminomethyl)cyclohexanecarboxylate hydrochloride, trans-Ethyl 4-(aminomethyl)cyclohexanecarboxylate HCl, ZGOGVHCRASZRFV-UHFFFAOYSA-N, SCHEMBL1068668, CHEMBL3084611, SCHEMBL11075182, KS-00000SNK, AKOS024462774, DS-7929, AK162936, Tranexamic Acid Ethyl Ester Hydrochloride, DB-108844, ethyl 4-(aminomethyl)cyclohexane-1-carboxylate;hydrochloride, 4-Aminomethyl-Cyclohexanecarboxylic Acid Ethyl Ester Hydrochloride, Cyclohexanecarboxylic acid, 4-(aminomethyl)-, ethyl ester, hydrochloride (1:1), trans-, (1R,4R)-ETHYL 4-(AMINOMETHYL)CYCLOHEXANECARBOXYLATE, N/A,

Complexity	162
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	221.118257g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	221.72g/mol
Monoisotopic Mass	221.118257g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	52.3Ų
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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