AG00I526

26750-81-2 | Benzamide, 2-hydroxy-N-(2-hydroxyethyl)-3-methoxy-5-(2-propenyl)-

AG00I526

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CAS Number	26750-81-2
Catalog Number	AG00I526(AGN-PC-0JLAH3)
Chemical Name	Benzamide, 2-hydroxy-N-(2-hydroxyethyl)-3-methoxy-5-(2-propenyl)-
EC Number	247-960-9
IUPAC Name	2-hydroxy-N-(2-hydroxyethyl)-3-methoxy-5-prop-2-enylbenzamide
InChI	InChI=1S/C13H17NO4/c1-3-4-9-7-10(13(17)14-5-6-15)12(16)11(8-9)18-2/h3,7-8,15-16H,1,4-6H2,2H3,(H,14,17)
InChI Key	UMJHTFHIQDEGKB-UHFFFAOYSA-N
MDL Number	MFCD00865165
Molecular Formula	C13H17NO4
Molecular Weight	251.2784
SMILES	O=C(NCCO)C1=CC(CC=C)=CC(OC)=C1O
UNII	A8CO1VZK2Z
Synonyms	Alibendol, 26750-81-2, cebera, Alibendol [INN:DCF], UNII-A8CO1VZK2Z, Alibendolum [INN-Latin], FC 54, EINECS 247-960-9, A8CO1VZK2Z, BRN 2735959, C13H17NO4, 5-Allyl-N-(2-hydroxyethyl)-3-methoxysalicylamide, 5-allyl-2-hydroxy-N-(2-hydroxyethyl)-3-methoxybenzamide, NCGC00164629-01, Benzamide, 2-hydroxy-N-(2-hydroxyethyl)-3-methoxy-5-(2-propenyl)-, Hydroxy-2 methoxy-3 allyl-5 N-(beta-hydroxy ethyl)benzamide [French], H 3774, DSSTox_CID_26490, DSSTox_RID_81661, DSSTox_GSID_46490, Alibendolum, Benzamide, 5-allyl-2-hydroxy-N-(2-hydroxyethyl)-3-methoxy-, 2-hydroxy-N-(2-hydroxyethyl)-3-methoxy-5-prop-2-enylbenzamide, CAS-26750-81-2, 5-allyl-2-hydroxy-n-(2-hydroxyethyl)-m-anisamide, AC1Q5DCF, SCHEMBL25070, MLS006011147, AC1L2H24, BEN465, m-Anisamide, 5-allyl-2-hydroxy-N-(2-hydroxyethyl)-, CHEMBL2105999, DTXSID4046490, CHEBI:135023, HMS3655F03, Hydroxy-2 methoxy-3 allyl-5 N-(beta-hydroxy ethyl)benzamide, PC-54, BCP13543, HY-B0326, ZINC1842915, Tox21_112247, AC-017, MFCD00865165, s1928, AKOS015894906, Tox21_112247_1, API0001410, CS-2367, EB 1856, NCGC00164629-02, NCGC00164629-03, AK546638, AN-16212, BC204735, CJ-30042, LS-25268, SC-45935, SMR002529526, AB0012819, AB2000379, TL8002126, FT-0630526, SW219612-1, A11676, AB01566848_01, 750A812, C-15509, I06-0095, 5-allyl-2-hydroxy-N-(2-hydroxyethyl)-3-methoxy-benzamide, m-Anisamide, 5-allyl-2-hydroxy-N-(2-hydroxyethyl)- (8CI), 2-Hydroxy-N-(2-hydroxyethyl)-3-methoxy-5-(2-propenyl)benzamide, 2-hydroxy-N-(2-hydroxyethyl)-3-methoxy-5-(prop-2-en-1-yl)benzamide, Benzamide, 2-hydroxy-N-(2-hydroxyethyl)-3-methoxy-5-(2-propen-1-yl)-, Benzamide, 2-hydroxy-N-(2-hydroxyethyl)-3-methoxy-5-(2-propenyl)- (9CI), null, Alibendol [DCF:INN], CID71916, AR-1G6975, C13-H17-N-O4, H001, A2965, B1881, 2-Hydroxy-N-(2-hydroxyethyl)-3-methoxy-5-(2-propen-1-yl)benzamide, 2765-59-5,

Complexity	282
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	251.116g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	251.282g/mol
Monoisotopic Mass	251.116g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	78.8A^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-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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