AG003SC4

41859-57-8 | 4-Chloro-N-(4-hydroxyphenethyl)benzamide

AG003SC4

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CAS Number	41859-57-8
Catalog Number	AG003SC4(AGN-PC-0WAE9O)
Chemical Name	4-Chloro-N-(4-hydroxyphenethyl)benzamide
EC Number	255-566-3
IUPAC Name	4-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide
InChI	InChI=1S/C15H14ClNO2/c16-13-5-3-12(4-6-13)15(19)17-10-9-11-1-7-14(18)8-2-11/h1-8,18H,9-10H2,(H,17,19)
InChI Key	ZTLWJYCDAXUIBK-UHFFFAOYSA-N
MDL Number	MFCD00218513
Molecular Formula	C15H14ClNO2
Molecular Weight	275.7302
SMILES	O=C(NCCC1=CC=C(O)C=C1)C2=CC=C(Cl)C=C2
Synonyms	41859-57-8, N-(4-Chlorobenzoyl)-tyramine, 4-Chloro-N-(4-hydroxyphenethyl)benzamide, 4-Chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide, N-(4-Chlorobenzoyl)tyramine, EINECS 255-566-3, Benzamide, p-chloro-N-(2-(p-hydroxyphenyl)ethyl)-, p-Chloro-N-(2-(p-hydroxyphenyl)ethyl)benzamide, Benzamide, 4-chloro-N-(2-(4-hydroxyphenyl)ethyl)-, MFCD00218513, 4-Chloro-N-(2-(4-hydroxyphenyl)ethyl)benzamide, Benzamide, 4-chloro-N-[2-(4-hydroxyphenyl)ethyl]-, MLS000551468, BEZ-da, 4-Chlorobenzoyltyramine, ACMC-209upo, AC1L54XT, Oprea1_126724, Oprea1_152220, KSC495Q6P, CHEMBL538430, SCHEMBL8668493, CTK3J5867, DTXSID80194653, ZTLWJYCDAXUIBK-UHFFFAOYSA-N, HMS2164E19, HMS3353E04, ZINC134547, EBD21519, KS-000010FL, ANW-44074, STL220572, AKOS005812091, AC-8430, AN-8039, CC-1631, MCULE-7626402334, NE35978, VZ32943, NCGC00246326-01, AJ-12231, AK-94068, LS-26109, R456, SMR000145393, ZB004720, DB-070227, RT-002740, FT-0660050, ST24029047, ST45244393, EN300-79153, 859C578, A825676, 4-chloranyl-N-[2-(4-hydroxyphenyl)ethyl]benzamide, 4-Chloro-N-[2-(4-hydroxy-phenyl)-ethyl]-benzamide, 4-Chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide #, W-106292, Z730649408, (4-chlorophenyl)-N-[2-(4-hydroxyphenyl)ethyl]carboxamide, 4-Chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide, AldrichCPR, 4-Chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide (4-Chlorobenzoyltyramine), N-(4-Chlorobenzoyl)-tyramine pound>>4-Chloro-N-[2-(4-hydroxy-phenyl)-ethyl]-benzamide, C15H14ClNO2, C15-H14-Cl-N-O2, CID198234, C2309, Benzamida, 4-cloro-N-[2-(4-hidroxifenil) etil]-,

Complexity	282
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	275.071g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	275.732g/mol
Monoisotopic Mass	275.071g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	49.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.4

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

Lot Number