AG003FZQ

610-72-0 | 2,5-Dimethylbenzoic Acid

AG003FZQ

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CAS Number	610-72-0
Catalog Number	AG003FZQ(AGN-PC-0JKAAF)
Chemical Name	2,5-Dimethylbenzoic Acid
EC Number	210-235-2
IUPAC Name	2,5-dimethylbenzoic acid
InChI	InChI=1S/C9H10O2/c1-6-3-4-7(2)8(5-6)9(10)11/h3-5H,1-2H3,(H,10,11)
InChI Key	XZRHNAFEYMSXRG-UHFFFAOYSA-N
MDL Number	MFCD00002482
Molecular Formula	C9H10O2
Molecular Weight	150.1745
SMILES	C1=C(C)C=CC(=C1C(O)=O)C
UNII	RKE5PMK0H6
Synonyms	2,5-DIMETHYLBENZOIC ACID, 610-72-0, Benzoic acid, 2,5-dimethyl-, Isoxylic acid, 2,5-Dimethyl benzoic acid, UNII-RKE5PMK0H6, 2,5-DiMethyl-Benzoic Acid, 2-Carboxy-1,4-dimethylbenzene, RKE5PMK0H6, p-Xylene-2-carboxylic Acid, XZRHNAFEYMSXRG-UHFFFAOYSA-N, 2,5-dimethylbenzenecarboxylic acid, 2,5-Dimethylbenzoic acid, 98%, MFCD00002482, 2,5-Dimethylbenzoicacid, p-Xylylic acid, EINECS 210-235-2, ACMC-1AXTK, AC1L1YDI, AC1Q2HPN, 2.5-dimethylbenzoic acid, KSC489O8N, SCHEMBL223101, RARECHEM AL BO 0034, DTXSID2060591, CHEBI:64825, CTK3I9786, KS-00000CDX, TIMTEC-BB SBB008434, 2,5-Dimethylbenzoic acid, 95%, HMS1767P14, ZINC157322, AKOS BBS-00009473, ANW-33671, LABOTEST-BB LT01148277, LABOTEST-BB LT03329739, SBB008434, STL169576, AKOS000119551, AC-3055, AN-5741, AS00745, CM12701, CS-W018147, FR-2050, FS-2352, MCULE-1885016168, RP21366, RTR-021040, VZ22812, OTAVA-BB 7019091163, TRA-0199445, AJ-14986, AK-48911, BR-48911, SC-17840, SY003687, DB-020124, TL8003865, TR-021040, AM20050120, D1433, FT-0610460, ST24032299, ST45021429, M-7334, MFCD00002482 (97+%), AE-562/43387288, I01-6772, W-105202, F2182-0128, 2,5-Dimethylbenzoic acid, Vetec(TM) reagent grade, 97%, InChI=1/C9H10O2/c1-6-3-4-7(2)8(5-6)9(10)11/h3-5H,1-2H3,(H,10,11, C9H10O2, CID11892, C9-H10-O2, 2,5-Dimethylbenzoic acid, 98% - 10G 10g, Benzoic acid, 2,5-dimethyl- (7CI,8CI,9CI),

Complexity	154
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	150.068g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	150.177g/mol
Monoisotopic Mass	150.068g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

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

Lot Number