AG003K3Y

500-76-5 | 4-(4-Hydroxyphenoxy)benzoic Acid

AG003K3Y

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CAS Number	500-76-5
Catalog Number	AG003K3Y(AGN-PC-0JTU9L)
Chemical Name	4-(4-Hydroxyphenoxy)benzoic Acid
IUPAC Name	4-(4-hydroxyphenoxy)benzoic acid
InChI	InChI=1S/C13H10O4/c14-10-3-7-12(8-4-10)17-11-5-1-9(2-6-11)13(15)16/h1-8,14H,(H,15,16)
InChI Key	KLXPCYHWTLAVLN-UHFFFAOYSA-N
MDL Number	MFCD00059645
Molecular Formula	C13H10O4
Molecular Weight	230.2161
SMILES	O=C(O)C1=CC=C(OC2=CC=C(O)C=C2)C=C1
Synonyms	4-(4-Hydroxyphenoxy)benzoic acid, 500-76-5, KLXPCYHWTLAVLN-UHFFFAOYSA-N, p-(p-Hydroxyphenoxy)benzoic acid, AC1LDBJY, AC1Q73FQ, ACMC-1B01A, SCHEMBL633482, 4-(4-hydoxyphenoxy)benzoic acid, 4-(4-Hydroxyphenoxy)benzoicAcid, CTK1G8516, DTXSID00346839, 4-(4-oxidanylphenoxy)benzoic acid, ZINC392302, 4-(4-hydroxy-phenoxy)benzoic acid, 4-(4'-Hydroxyphenoxy)benzoic acid, 4-(4-Hydroxyphenoxy)benzoic acid #, ANW-30910, MFCD00059645, STK286094, AKOS000113534, MCULE-6541411901, RTR-017933, ACM500765|1, KS-0000163F, AJ-21228, CC-16579, DB-051726, TR-017933, 4-(4-HYDROXY-PHENOXY)-BENZOIC ACID, FT-0616637, 4-(4-Hydroxyphenoxy)benzoic acid, AldrichCPR, A827963, C-13328, 4- BENZOICACID, CID615542, H0642,

Complexity	250
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	230.058g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	230.219g/mol
Monoisotopic Mass	230.058g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	66.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number