AG003MN5

3438-16-2 | 5-Chloro-2-methoxybenzoic acid

AG003MN5

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CAS Number	3438-16-2
Catalog Number	AG003MN5(AGN-PC-0JLQE2)
Chemical Name	5-Chloro-2-methoxybenzoic acid
EC Number	222-343-7
IUPAC Name	5-chloro-2-methoxybenzoic acid
InChI	InChI=1S/C8H7ClO3/c1-12-7-3-2-5(9)4-6(7)8(10)11/h2-4H,1H3,(H,10,11)
InChI Key	HULDRQRKKXRXBI-UHFFFAOYSA-N
MDL Number	MFCD00024301
Molecular Formula	C8H7ClO3
Molecular Weight	186.5924
SMILES	O=C(O)C1=CC(Cl)=CC=C1OC
Synonyms	5-Chloro-2-methoxybenzoic acid, 3438-16-2, 5-Chloro-o-anisic acid, 5-Chloro-2-methoxy-benzoic acid, Benzoic acid, 5-chloro-2-methoxy-, 5-Chloro-2-methoxybenzoicacid, 2-Methoxy-5-chlorobenzoic Acid, MFCD00017546, 5-CHLORO-2-ANISIC ACID, HULDRQRKKXRXBI-UHFFFAOYSA-N, EINECS 222-343-7, PubChem2680, AC1Q3LTA, AC1Q4CLW, 2-Carboxy-4-chloroanisole, AC1L2S2O, 5-chloro-2-methoxy-benzoate, 5-Chloro-methoxybenzoic acid, SCHEMBL48961, ACMC-209i72, Jsp006231, RARECHEM AL BO 0576, 5-Chloro-o-anisic acid, 99%, CTK7A5684, KS-00000CNR, DTXSID80187949, ZINC164654, EBD54430, 5-chloro-2-(methyloxy)benzoic acid, ANW-27852, SBB063166, STL164312, AKOS000112227, 5-Chloro-2-methoxybenzoic acid, 99%, AS02795, CS-W016879, FS-3182, LS10620, MCULE-4487698118, RP24661, TRA0088585, VZ35639, OTAVA-BB 7119850441, AC-23552, AJ-16256, AK-47654, BR-47654, SC-46600, SY013488, AB0011141, AB1001867, DB-011445, ST2411942, TR-014252, AM20060318, BB 0244071, FT-0620326, ST45028564, C80250, M-3962, MFCD00017546 (97+%), I01-0675, W-106739, F0211-0007, Z118458680, InChI=1/C8H7ClO3/c1-12-7-3-2-5(9)4-6(7)8(10)11/h2-4H,1H3,(H,10,11, C8H7ClO3, o-Anisic acid, 5-chloro-, C8-H7-Cl-O3, CID76970, AR-1G7741, C1539, 5-Chloro-2-methoxybenzoic acid, 99% - 100G 100g,

Complexity	172
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	186.008g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	186.591g/mol
Monoisotopic Mass	186.008g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	46.5A^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