AG002IGT

20637-09-6 | Benzenebutanoic acid, 4-amino-, methyl ester

AG002IGT

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CAS Number	20637-09-6
Catalog Number	AG002IGT(AGN-PC-0JLXJW)
Chemical Name	Benzenebutanoic acid, 4-amino-, methyl ester
EC Number	243-933-0
IUPAC Name	methyl 4-(4-aminophenyl)butanoate
InChI	InChI=1S/C11H15NO2/c1-14-11(13)4-2-3-9-5-7-10(12)8-6-9/h5-8H,2-4,12H2,1H3
InChI Key	CLKHQWJXESOLCJ-UHFFFAOYSA-N
MDL Number	MFCD07366753
Molecular Formula	C11H15NO2
Molecular Weight	193.2423
SMILES	C(CCC(=O)OC)c1ccc(cc1)N
Synonyms	Methyl 4-(4-aminophenyl)butanoate, 20637-09-6, Methyl 4-(4-aminophenyl)butyrate, Benzenebutanoic acid, 4-amino-, methyl ester, methyl 4-(4-aminophenyl)butyarte, 4-(4-Aminophenyl)butanoic acid methyl ester, methyl-4(4-aminophenyl)butanoate, CLKHQWJXESOLCJ-UHFFFAOYSA-N, Butyric acid, 4-(p-aminophenyl)-, methyl ester, AK109314, Methyl4-(4-aminophenyl)butyrate, EINECS 243-933-0, AC1Q5ZY9, Methyl 4-aminobenzenebutanoate, methyl 4-p-aminophenylbutyrate, AC1L3G50, SCHEMBL1351101, CTK4E4751, KS-00000GDR, DTXSID40174673, Methyl 4-(p-aminophenyl)butyrate, ZINC5318933, Methyl-4-(4-aminophenyl)-butanoate, ANW-72872, MFCD07366753, AKOS006286040, 4-Aminobenzenebutyric acid methyl ester, CS-W005992, DS-4189, VZ32621, ACM20637096, AC-20513, AJ-53806, BC216565, CC-30600, CJ-12568, R798, AB0018341, AX8013338, DB-045316, TX-011361, 4-(4-Aminophenyl) butyric acid methyl ester, 4CH-007352, Benzenebutanoic acid,4-amino-, methyl ester, FT-0638025, ST24031065, A18431, M-8455, 637M096, C-08581, I01-9626, C11H15NO2, 4-(4-Boc-piperazin-1-yl)aniline, CID88628, AR-1J5250, C11-H15-N-O2, A3767, Tert-butyl 4-(4-aminophenyl)piperazine-1-carboxylate, 170911-92-9, 21165-53-7,

Complexity	174
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	193.11g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	193.246g/mol
Monoisotopic Mass	193.11g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	52.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number