AG003M02

88038-94-2 | 4-Propyl-[1,1-Biphenyl]-4-carboxylic acid

AG003M02

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CAS Number	88038-94-2
Catalog Number	AG003M02(AGN-PC-0JSAVC)
Chemical Name	4-Propyl-[1,1-Biphenyl]-4-carboxylic acid
IUPAC Name	4-(4-propylphenyl)benzoic acid
InChI	InChI=1S/C16H16O2/c1-2-3-12-4-6-13(7-5-12)14-8-10-15(11-9-14)16(17)18/h4-11H,2-3H2,1H3,(H,17,18)
InChI Key	HCPBURTZSXRGBN-UHFFFAOYSA-N
MDL Number	MFCD00017335
Molecular Formula	C16H16O2
Molecular Weight	240.2970
SMILES	CCCC1=CC=C(C=C1)C1=CC=C(C=C1)C(O)=O
Synonyms	88038-94-2, 4-(4-n-Propylphenyl)benzoic acid, 4-(4-Propylphenyl)benzoic Acid, 4'-Propyl-[1,1'-Biphenyl]-4-carboxylic acid, 4'-Propylbiphenyl-4-carboxylic Acid, 4-Propylbiphenyl-4'-carboxylic acid, 4-Propyl-4'-biphenylcarboxylic acid, 4-n-Propylbiphenyl-4'-carboxylic acid, 4-(p-n-Propylphenyl)benzoic acid, HCPBURTZSXRGBN-UHFFFAOYSA-N, [1,1'-Biphenyl]-4-carboxylic acid, 4'-propyl-, MFCD00017335, 4'-n-propylbiphenyl-4-carboxylic acid, 4-Propyl-[1,1-Biphenyl]-4-carboxylic acid, 4-(4-propylphenyl]benzoic acid, zlchem 408, PubChem9068, AC1LAXIQ, ACMC-209qqx, rarechem al bo 0888, SCHEMBL200372, 4-(4-Propylphenyl)benzoicAcid, CHEMBL197499, 4-(4-propylphenyl)-benzoic acid, DTXSID00335102, ZLC0262, Np(4-N-propylphenyl)benzoic acid, ZINC157084, 4030AC, ANW-38935, SBB059167, AKOS009157307, 4'-n-Propyl-4-biphenylcarboxylic acid, IMED1136658696, MCULE-4167147266, VZ27817, KS-000013P2, AJ-14875, AN-35432, AS-40175, CC-16639, AX8008758, TC-127680, FT-0616665, P1037, ST50307151, 4'-n-Propylbiphenyl-4-carboxylic acid, 98%, 4'-Propyl[1,1'-biphenyl]-4-carboxylic acid #, 038N942, C-14408, 4-N-Propylbiphenyl-4'-carboxylic acid, AldrichCPR, 4-Propylbiphenyl-4-Carboxylic Acid, C16H16O2, CID522891, 4'-Propyl-[1,1'-Biphenyl]-4-carboxylicacid, 11-(Maleimido)undecanoic acid N-succinimidyl ester,

Complexity	258
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	240.115g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	240.302g/mol
Monoisotopic Mass	240.115g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	5

GHS Hazard and Precautionary Statements

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

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