AG00337V

2252-51-9 | 2-Chloro-4-fluorobenzoic acid

AG00337V

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CAS Number	2252-51-9
Catalog Number	AG00337V(AGN-PC-0JLP8O)
Chemical Name	2-Chloro-4-fluorobenzoic acid
EC Number	218-845-0
IUPAC Name	2-chloro-4-fluorobenzoic acid
InChI	InChI=1S/C7H4ClFO2/c8-6-3-4(9)1-2-5(6)7(10)11/h1-3H,(H,10,11)
InChI Key	GRPWQLDSGNZEQE-UHFFFAOYSA-N
MDL Number	MFCD00010615
Molecular Formula	C7H4ClFO2
Molecular Weight	174.5569
SMILES	ClC1=C(C(=O)O)C=CC(=C1)F
Synonyms	2-Chloro-4-fluorobenzoic acid, 2252-51-9, Benzoic acid, 2-chloro-4-fluoro-, 2-chloro-4-fluoro-benzoic acid, MFCD00010615, 2-chloro-4-fluor obenzoic acid, GRPWQLDSGNZEQE-UHFFFAOYSA-N, 2-Chloro-4-fluorobenzoic acid, 99%, EINECS 218-845-0, PubChem1370, AC1L2ODR, ACMC-209fx5, KSC207E4N, SCHEMBL195310, AC1Q5U09, AC1Q727V, RARECHEM AL BO 0405, 2-chloro 4-fluoro benzoic acid, 2-chloro-4-fluoro benzoic acid, 4-fluoro-2-chloro-benzoic acid, CTK1A7246, TIMTEC-BB SBB003795, DTXSID90177038, Benzoicacid, 2-chloro-4-fluoro-, ZINC404792, ACT11973, CS-D1753, JRD-0875, KS-000000MT, ANW-24903, SBB003795, STL169009, AKOS000120087, AC-3928, AS00965, BS-3950, MCULE-8034931020, RP23662, RP23667, RTC-062266, TF10430, TRA0031019, VZ24236, AJ-22419, AN-12481, BR-34206, SC-02607, SY005366, TL806106, AB0011827, AB1001862, DB-011385, ST2416705, TC-062266, FT-0082356, FT-0611760, ST50406039, MFCD00010615 (98%), A21276, C-4611, Z-9574, I01-1677, W-107468, F2191-0039, Z1262254164, InChI=1/C7H4ClFO2/c8-6-3-4(9)1-2-5(6)7(10)11/h1-3H,(H,10,11, null, C7H4ClFO2, 2-Chloro-4-fluorobenzoicacid, 5-Fluoro-2-methylbenzaldehyde, C7-H4-Cl-F-O2, 5-fluoro-2-methyl-benzaldehyde, CID75259, AR-1E0228, c1350, 2-Chloro-4-fluorobenzoic acid, 99% - 25G 25g, 22062-53-9, 23256-42-0, 92421-68-6,

Complexity	163
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	173.988g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	174.555g/mol
Monoisotopic Mass	173.988g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

Lot Number