AG00CA95

3633-17-8 | 6-AMINOCAPRONIC ACID ETHYL ESTER HYDROCHLORIDE

AG00CA95

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CAS Number	3633-17-8
Catalog Number	AG00CA95(AGN-PC-0JRGNS)
Chemical Name	6-AMINOCAPRONIC ACID ETHYL ESTER HYDROCHLORIDE
IUPAC Name	ethyl 6-aminohexanoate;hydrochloride
InChI	InChI=1S/C8H17NO2.ClH/c1-2-11-8(10)6-4-3-5-7-9;/h2-7,9H2,1H3;1H
InChI Key	MMSVBKQTXSDWQN-UHFFFAOYSA-N
MDL Number	MFCD00972035
Molecular Formula	C8H18ClNO2
Molecular Weight	195.6870
NSC Number	226
SMILES	Cl.NCCCCCC(=O)OCC
Synonyms	ethyl 6-aminohexanoate hydrochloride, 3633-17-8, 6-Aminocapronic acid ethyl ester hydrochloride, AK145590, AC1L9YHI, Ethyl 6-aminohexanoate HCl, epsilon-Aminocaproic acid, ethyl ester, hydrochloride, NSC226, SCHEMBL1284223, KS-00000FCY, DTXSID10332521, NSC-226, MMSVBKQTXSDWQN-UHFFFAOYSA-N, Ethyl 6-aminocaproate hydrochloride, ethyl 6-aminohexanoate,hydrochloride, MFCD00972035, AKOS016353033, ACM3633178, CS-W005831, GS-6202, MCULE-5512054492, 6-AMINOHEXANOIC ACID, HYDROCHLORIDE, AX8108164, ST2413048, 4CH-016593, FT-0758463, C-29406, Hexanoicacid, 6-amino-, ethyl ester, hydrochloride (1:1), ethyl 6-aminohexanoate, ethyl 6-aminohexanoate;hydrochloride, CID458476, ACN-052428, 6-AMINOCAPRONICACIDETHYLESTERHYDROCHLORIDE, 754-05-2,

Complexity	104
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	195.103g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	195.687g/mol
Monoisotopic Mass	195.103g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	52.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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