AG003GXD

440123-65-9 | 2-Chloro-4-hydroxybenzoic acid hydrate

AG003GXD

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CAS Number	440123-65-9
Catalog Number	AG003GXD(AGN-PC-09SH3D)
Chemical Name	2-Chloro-4-hydroxybenzoic acid hydrate
IUPAC Name	2-chloro-4-hydroxybenzoic acid;hydrate
InChI	InChI=1S/C7H5ClO3.H2O/c8-6-3-4(9)1-2-5(6)7(10)11;/h1-3,9H,(H,10,11);1H2
InChI Key	LVNLXWMDILTYQC-UHFFFAOYSA-N
MDL Number	MFCD00045855
Molecular Formula	C7H7ClO4
Molecular Weight	190.5811
SMILES	O=C(O)C1=CC=C(O)C=C1Cl.[H]O[H]
Synonyms	2-Chloro-4-hydroxybenzoic acid hydrate, 440123-65-9, ACMC-209ls1, C7H5ClO3.H2O, SCHEMBL694945, KS-00000CAL, 4-Carboxy-3-chlorophenol hydrate, DTXSID80694148, LVNLXWMDILTYQC-UHFFFAOYSA-N, ACN-S003389, 2-Chloro-4-hydroxybenzoicAcidHydrate, 5021AH, ANW-32495, MFCD00798116, AKOS005259701, AM82918, PS-4320, TRA0047138, W63C849, 2-chloro-4-hydroxy benzoic acid hydrate, 2-chloro-4-hydroxy-benzoic acid hydrate, SY002123, ST2416709, TC-121240, FT-0664713, 2-Chloro-4-hydroxybenzoic acid hydrate 98+%, 2-Chloro-4-hydroxybenzoic acid--water (1/1), Z-4497, MFCD00798116 (97+%), 2-Chloro-4-hydroxybenzoic acid, 56363-84-9, 105-87-3,

Complexity	160
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	190.003g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	190.579g/mol
Monoisotopic Mass	190.003g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	58.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P301+P312+P330
UN Code

Certificate of Analysis

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