AG007YZ1

143269-74-3 | 3-Amino-4-chlorobenzoic acid hexadecyl ester

AG007YZ1

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CAS Number	143269-74-3
Catalog Number	AG007YZ1(AGN-PC-0LAEF5)
Chemical Name	3-Amino-4-chlorobenzoic acid hexadecyl ester
EC Number	419-700-6
IUPAC Name	hexadecyl 3-amino-4-chlorobenzoate
InChI	InChI=1S/C23H38ClNO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-27-23(26)20-16-17-21(24)22(25)19-20/h16-17,19H,2-15,18,25H2,1H3
InChI Key	WZPMUDCUMKEHSE-UHFFFAOYSA-N
MDL Number	MFCD00186289
Molecular Formula	C23H38ClNO2
Molecular Weight	396.0063
SMILES	O=C(OCCCCCCCCCCCCCCCC)C1=CC=C(Cl)C(N)=C1
Synonyms	143269-74-3, hexadecyl 3-amino-4-chlorobenzoate, 3-amino-4-chlorobenzoic acid hexadecyl ester, 3-Amino-4-chloro benzoic acid hexadecylester, 3-Amino-4-chloro benzoic acid hexadecyl ester, AK112265, 3-AMINO-4-CHLORO BENZOIC HEXADECYL ESTER, Benzoic acid,3-amino-4-chloro-, hexadecyl ester, Benzoic acid, 3-amino-4-chloro-, hexadecyl ester, Hexadecyl 3-amino-4-chloro-benzoate, ACMC-20c3xi, AC1NA4LV, 3-amino-4-chlorobenzoic acid, hexadecyl ester, EC 419-700-6, C23H38ClNO2, SCHEMBL11116165, CTK4C3555, WZPMUDCUMKEHSE-UHFFFAOYSA-N, ACT07552, KS-00000HQ1, MFCD00186289, n-Hexadecyl-3-amino-4-chlorobenzoate, AKOS015839837, ZINC100006878, AM84390, DS-5472, MCULE-9913308064, 3-amino-4-chlorobenzoic hexadecyl ester, hexadecyl 3-azanyl-4-chloranyl-benzoate, AC-19475, AN-31560, I272, hexadecylester, 3-amino-4-chloro benzoate, AX8001603, DB-025386, TC-061449, TL8000950, FT-0652648, ST24030756, 269A743, 3-amino-4-chlorobenzoicacidhexadecylesterappearance, A808050, I01-6464, CID4395990, 3-Amino-4-chlorobenzoicacidhexadecylester, 3-Amino-4-chlorobenzoic acid hexadecylester,

Complexity	364
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	395.259g/mol
Formal Charge	0
Heavy Atom Count	27
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	396.012g/mol
Monoisotopic Mass	395.259g/mol
Rotatable Bond Count	17
Topological Polar Surface Area	52.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	9.5

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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