AG003Q2Y

1128-00-3 | Ethyl 2-aminocyclohex-1-enecarboxylate

AG003Q2Y

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CAS Number	1128-00-3
Catalog Number	AG003Q2Y(AGN-PC-0JOTZU)
Chemical Name	Ethyl 2-aminocyclohex-1-enecarboxylate
IUPAC Name	ethyl 2-aminocyclohexene-1-carboxylate
InChI	InChI=1S/C9H15NO2/c1-2-12-9(11)7-5-3-4-6-8(7)10/h2-6,10H2,1H3
InChI Key	JBZVWABPSHNPIK-UHFFFAOYSA-N
MDL Number	MFCD01863243
Molecular Formula	C9H15NO2
Molecular Weight	169.2209
NSC Number	225254
SMILES	CCOC(=O)C1=C(N)CCCC1
Synonyms	1128-00-3, ethyl 2-aminocyclohex-1-enecarboxylate, Ethyl 2-amino-1-cyclohexene-1-carboxylate, 2-Amino-cyclohex-1-enecarboxylic acid ethyl ester, ethyl 2-aminocyclohex-1-ene-1-carboxylate, ethyl 2-aminocyclohexene-1-carboxylate, 2-Amino-1-cyclohexenecarboxylic acid ethyl ester, 1-Cyclohexene-1-carboxylic acid, 2-amino-, ethyl ester, 1-Cyclohexene-1-carboxylicacid, 2-amino-, ethyl ester, NSC225254, AC1L7MDX, 2-Amino-cyclohex-1-enecarboxylicacidethylester, SCHEMBL1144592, CTK4A7973, DTXSID90310322, JBZVWABPSHNPIK-UHFFFAOYSA-N, AA008, ALBB-025572, BCP27748, KS-00000AI9, ZX-AN024086, 2221AA, ANW-71455, GEO-03438, MFCD01863243, SBB072592, ZINC19943216, AKOS003342974, AKOS025243363, ethyl cis-2-aminocyclohexenecarboxylate, FCH1118063, GS-0615, MCULE-3127663767, NSC-225254, RP23164, TRA0169167, VZ32030, AC-23496, AJ-75761, AK-83411, BP-12872, CC-27741, CJ-16515, Ethyl2-Amino-1-cyclohexene-1-carboxylate, SY013212, AB0055849, DB-041120, TC-160200, A2275, FT-0633379, ST45028531, K-0970, 2-Aminocyclohex-1-enecarboxylic acid ethyl ester, 2-Aminocyclohexene-1-carboxylic acid ethyl ester, MFCD01863243 (97+%), C-05167, Ethyl 2-amino-1-cyclohexene-1-carboxylate, 98%, J-508033, I14-15526, C9H15NO2, CID312929, 2-Amino-cyclohex-1-enecarboxylic acid ethyl ester, 98% - 1G 1g,

Complexity	209
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	169.11g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	169.224g/mol
Monoisotopic Mass	169.11g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	52.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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