AG0036FA

83846-66-6 | 1-(4-Methylphenyl)-1-cyclopropanecarboxylic Acid

AG0036FA

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CAS Number	83846-66-6
Catalog Number	AG0036FA(AGN-PC-0JM34K)
Chemical Name	1-(4-Methylphenyl)-1-cyclopropanecarboxylic Acid
EC Number	281-043-4
IUPAC Name	1-(4-methylphenyl)cyclopropane-1-carboxylic acid
InChI	InChI=1S/C11H12O2/c1-8-2-4-9(5-3-8)11(6-7-11)10(12)13/h2-5H,6-7H2,1H3,(H,12,13)
InChI Key	AYUGAOYMYXSOKU-UHFFFAOYSA-N
MDL Number	MFCD00066918
Molecular Formula	C11H12O2
Molecular Weight	176.2118
NSC Number	156080
SMILES	OC(=O)C1(CC1)c1ccc(cc1)C
Synonyms	83846-66-6, 1-(p-Tolyl)cyclopropanecarboxylic acid, 1-(4-methylphenyl)cyclopropanecarboxylic acid, 1-(4-Methylphenyl)-1-cyclopropanecarboxylic acid, 1-p-tolylcyclopropanecarboxylic acid, 1-(4-methylphenyl)cyclopropane-1-carboxylic acid, 1-p-Tolyl-cyclopropanecarboxylic acid, CYCLOPROPANECARBOXYLIC ACID, 1-(4-METHYLPHENYL)-, 1-(4-METHYLPHENYL)-1-CYCLOPROPAN CARBOXYLIC ACID, EINECS 281-043-4, NSC156080, AC1Q2JYD, AC1Q5UJL, AC1L40BB, SCHEMBL351393, CTK3E9948, DTXSID40232742, AYUGAOYMYXSOKU-UHFFFAOYSA-N, ZINC394697, 2906AC, ANW-54441, BBL103373, CT-639, MFCD00066918, SBB005451, STL557183, AKOS009375560, AB02714, CS-W005583, MCULE-3269659985, NSC-156080, KS-00003T98, AJ-21416, AK-87129, AN-36004, SC-51774, ST057589, SY057605, TS-02439, 1-(p-Tolyl)cyclopropane-1-carboxylic acid, DB-075984, TX-015777, FT-0694274, ST24037637, MFCD00066918 (97%), T80174, Cyclopropanecarboxylicacid, 1-(4-methylphenyl)-, 1-(4-methylphenyl)-1-cyclopropane carboxylic acid, 846M666, 1-(4-methylphenyl)-1-cyclopropanecarboxylic acid, 98, I04-10273, 1-(4-Methylphenyl)-1-cyclopropanecarboxylic acid, 98%, 1-(4-methylphenyl)-1-cyclopropanecarboxylic acid, 98% 10gr, KST-1B9073, C11H12O2, CID98639, AR-1B2267, 2-(bromomethyl)-1,3-dimethylbenzene, C11-H12-O2, 1- -1-CYCLOPROPANECARBOXYLICACID, 89595-54-0, 1-Hexadecanaminium, N,N'-((methylimino)di-2,1-ethanediyl)bis(N,N-dimethyl-, dibromide,

Complexity	210
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	176.084g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	176.215g/mol
Monoisotopic Mass	176.084g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

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

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