AG0036Z0

6342-60-5 | 2-Chloro-5-methylbenzoic acid

AG0036Z0

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CAS Number	6342-60-5
Catalog Number	AG0036Z0(AGN-PC-0JOFEP)
Chemical Name	2-Chloro-5-methylbenzoic acid
IUPAC Name	2-chloro-5-methylbenzoic acid
InChI	InChI=1S/C8H7ClO2/c1-5-2-3-7(9)6(4-5)8(10)11/h2-4H,1H3,(H,10,11)
InChI Key	LEBWXJZAWTVKFL-UHFFFAOYSA-N
MDL Number	MFCD00045798
Molecular Formula	C8H7ClO2
Molecular Weight	170.5930
NSC Number	46623
SMILES	ClC1=C(C(=O)O)C=C(C=C1)C
Synonyms	2-CHLORO-5-METHYLBENZOIC ACID, 6342-60-5, 6-Chloro-m-toluic Acid, 2-chloro-5-methylbenzole acid, Benzoic acid, 2-chloro-5-methyl-, LEBWXJZAWTVKFL-UHFFFAOYSA-N, MFCD00045798, 2-Chloro-5-methylbenzoic acid, 98%, NSC46623, PubChem12501, AC1Q5TOL, 3-Carboxy-4-chlorotoluene, ACMC-1B72O, KSC497Q1D, SCHEMBL306765, 2-Chloro-5-methylbenozic acid, 2-chloro-5-methyl-benzoic acid, CTK3J7811, LEBWXJZAWTVKFL-UHFFFAOYSA-, DTXSID70286591, OTAVA-BB 1506259, WT229, AC1L6566, ACN-S004279, ACT07321, KS-000001YI, ZINC1678775, ANW-34633, CL8041, NSC-46623, AKOS000298655, AS00923, CM12592, CS-W008213, FS-2540, MCULE-6194147933, RTC-062273, VZ34616, AC-26026, AJ-29540, AK-35943, BC207064, BR-35943, SC-23684, SY012919, 2-Chloro-5-methylbenzoic acid, AldrichCPR, AB0030595, AB1006245, DB-031105, ST2409876, TC-062273, 4CH-000866, 6342-60-5 2-chloro-5-methylbenzoic acid, AM20060267, C1780, FT-0084987, FT-0636105, ST50407519, X2803, MFCD00045798 (98%), S-1707, I01-13959, F0001-1723, InChI=1/C8H7ClO2/c1-5-2-3-7(9)6(4-5)8(10)11/h2-4H,1H3,(H,10,11), C8H7ClO2, 2-CHLORO-5-METHYLBENZOICACID, AR-1E0316, CID240430, 2-Chloro-5-methylbenzoic acid, 98% - 1G 1g, 7227-92-1,

Complexity	158
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	170.013g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	170.592g/mol
Monoisotopic Mass	170.013g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	9
Hazard statements	H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 3077

Certificate of Analysis

Lot Number