AG002X2C

28917-43-3 | Benzoic acid, 3,5-bis(phenylmethoxy)-

AG002X2C

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CAS Number	28917-43-3
Catalog Number	AG002X2C(AGN-PC-0JM3JN)
Chemical Name	Benzoic acid, 3,5-bis(phenylmethoxy)-
EC Number	249-311-5
IUPAC Name	3,5-bis(phenylmethoxy)benzoic acid
InChI	InChI=1S/C21H18O4/c22-21(23)18-11-19(24-14-16-7-3-1-4-8-16)13-20(12-18)25-15-17-9-5-2-6-10-17/h1-13H,14-15H2,(H,22,23)
InChI Key	DHQIBPUGSWVDOH-UHFFFAOYSA-N
MDL Number	MFCD00191341
Molecular Formula	C21H18O4
Molecular Weight	334.3652
NSC Number	210283
SMILES	OC(=O)C1=CC(OCC2=CC=CC=C2)=CC(OCC2=CC=CC=C2)=C1
Synonyms	3,5-dibenzyloxybenzoic acid, 28917-43-3, 3,5-Bis(benzyloxy)benzoic acid, 3,5-Bis(phenylmethoxy)benzoic acid, Benzoic acid, 3,5-bis(phenylmethoxy)-, DHQIBPUGSWVDOH-UHFFFAOYSA-N, Benzoic acid,3,5-bis(phenylmethoxy)-, W-107021, EINECS 249-311-5, NSC210283, ACMC-1BN7T, AC1L40SY, AC1Q5V1A, MLS001195542, 3,5-Dibenzyloxy benzoic acid, SCHEMBL1426961, Jsp005519, CHEMBL1442749, Benzoic acid, 3,5-dibenzyloxy-, CTK4G2392, DTXSID70183112, HMS2855F12, 3,5-Bis(benzyloxy)benzoic acid #, BCP21424, ZINC1393656, ZX-AT016298, ANW-26501, CD-209, MFCD00191341, SBB063339, AKOS005094175, MCULE-5793867192, NSC-210283, TRA0075738, VZ25688, ACM28917433, 3,5-bis(benzyloxy)benzenecarboxylic acid, NCGC00246551-01, AC-11760, AJ-25544, AK-48108, CC-13414, SMR000550298, AX8001320, DB-006291, TL8005877, TR-012679, D2267, FT-0081290, FT-0614493, ST51045762, 90373-EP2301929A1, 90373-EP2301935A1, 90373-EP2305674A1, 5W-0042, A819672, C-20149, I01-1353, 3,5-DIBENZYLOXYBENZOICACID, CID99307, AR-1E9445, C21-H18-O4, 3,5-Dibenzyloxybenzoic acid, 98% 5g, 97645-26-6,

Complexity	369
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	334.121g/mol
Formal Charge	0
Heavy Atom Count	25
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	334.371g/mol
Monoisotopic Mass	334.121g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	55.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

Lot Number