AG003RJI

57060-88-5 | Methyl 1,2,3,4-tetrahydro-isoquinoline-3-carboxylate, HCl

AG003RJI

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CAS Number	57060-88-5
Catalog Number	AG003RJI(AGN-PC-0J81I9)
Chemical Name	Methyl 1,2,3,4-tetrahydro-isoquinoline-3-carboxylate, HCl
IUPAC Name	methyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate;hydrochloride
InChI	InChI=1S/C11H13NO2.ClH/c1-14-11(13)10-6-8-4-2-3-5-9(8)7-12-10;/h2-5,10,12H,6-7H2,1H3;1H
InChI Key	BUXCBOUGBHWQBE-UHFFFAOYSA-N
MDL Number	MFCD00157120
Molecular Formula	C11H14ClNO2
Molecular Weight	227.6874
SMILES	O=C(C1NCC2=C(C=CC=C2)C1)OC.[H]Cl
Synonyms	57060-88-5, methyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride, methyl 1,2,3,4-tetrahydro-isoquinoline-3-carboxylate hydrochloride, Methyl (S)-1,2,3,4-Tetrahydroisoquinoline-3-carboxylate Hydrochloride, 1,2,3,4-Tetrahydro-3-isoquinolinecarboxylic acid methyl ester hydrochloride, 1,2,3,4-Tetrahydro-isoquinoline-3-carboxylic acid methyl ester hydrochloride, methyl 1,2,3,4-tetrahydro-3-isoquinolinecarboxylate hydrochloride, AC1Q3BWV, SCHEMBL8724704, CTK1G9263, BUXCBOUGBHWQBE-UHFFFAOYSA-N, KS-00000BT2, MFCD00157120, AKOS015897408, MCULE-4504689301, TRA0055251, TRA0080470, AK130460, AK152016, QC-10112, SY026663, SY026679, AB0069316, RT-005790, 4CH-002069, FT-0630308, Z4895, EN300-31896, M-9344, MFCD00157120 (95+%), MFCD05861484 (95+%), I08-999, J-008192, I14-11884, I14-37630, Methyl 1,2,3,4-tetrahydro-isoquinoline-3-carboxylate, HCl, Methyl1,2,3,4-Tetrahydroisoquinoline-3-carboxylateHydrochloride, METHYL 1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLATE HCL, 1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid methyl ester hydrochloride, methyl (3R)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate;hydrochloride, methyl (3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate;hydrochloride, Methyl 1,2,3,4-tetrahydro-3-isoquinolinecarboxylate hydrochloride (1:1), 1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid methyl ester, hydrochloride, 1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid, methyl ester hydrochloride, 3-isoquinolinecarboxylic acid, 1,2,3,4-tetrahydro-, methyl ester, hydrochloride, 3-Isoquinolinecarboxylicacid,1,2,3,4-tetrahydro-,methyl ester,hydrochloride,(3R)-(9ci), C11H14ClNO2, CS-4365, 146074-43-3, 78183-55-8, (s)-methyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride, (R)-methyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride, S-(-)-1,2,3,4-Tetrahydro-3-isoquinolinecarboxylic acid methyl ester HCL, (s)-l-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid methyl ester hydrochloride, -1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLICACIDMETHYLESTERHYDROCHLORIDE, l-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid methyl ester hydrochloride,

Complexity	217
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	227.071g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	227.688g/mol
Monoisotopic Mass	227.071g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	38.3A^2
Undefined Atom Stereocenter Count	1
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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