AG0033IE

5807-30-7 | 3,4-Dichlorophenylacetic acid

AG0033IE

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CAS Number	5807-30-7
Catalog Number	AG0033IE(AGN-PC-0JLSB2)
Chemical Name	3,4-Dichlorophenylacetic acid
EC Number	227-368-7
IUPAC Name	2-(3,4-dichlorophenyl)acetic acid
InChI	InChI=1S/C8H6Cl2O2/c9-6-2-1-5(3-7(6)10)4-8(11)12/h1-3H,4H2,(H,11,12)
InChI Key	ZOUPGSMSNQLUNW-UHFFFAOYSA-N
MDL Number	MFCD00004333
Molecular Formula	C8H6Cl2O2
Molecular Weight	205.0380
NSC Number	132186
SMILES	ClC=1C=C(C=CC1Cl)CC(=O)O
Synonyms	3,4-Dichlorophenylacetic acid, 5807-30-7, 2-(3,4-dichlorophenyl)acetic acid, (3,4-dichlorophenyl)acetic acid, 3,4-Dichlorobenzene acetic acid, Benzeneacetic acid, 3,4-dichloro-, 3,4-dichlorophenyl acetic acid, ZOUPGSMSNQLUNW-UHFFFAOYSA-N, MFCD00004333, EINECS 227-368-7, NSC 132186, PubChem20195, AC1L2YBX, ACMC-209m2g, AC1Q3O8M, AC1Q74WH, 3,4DichloroPhenylAceticAcid, 3,4dichlorophenylacetic acid, 3,4-DichlorophenylaceticAcid, KSC273E7R, SCHEMBL283587, 3,4-dichlorophenyl-acetic acid, RARECHEM AL BO 0123, CHEMBL3116309, 3,4-dichloro phenyl acetic acid, CTK1H3278, KS-00000CCT, TIMTEC-BB SBB003501, DTXSID70206794, ZINC156509, (3,4-dichloro-phenyl) acetic acid, (3,4-dichloro-phenyl)-acetic acid, STR02969, ANW-32870, LABOTEST-BB LT00455049, LABOTEST-BB LT03331902, NSC132186, SBB003501, STK428923, 2-(3,4-dichlorophenyl) acetic acid, 3,4-Dichlorophenylacetic acid, 98%, AKOS000112358, AC-2903, ACN-050967, AS00498, CS-W020073, MCULE-1698590133, NSC-132186, RP26127, RTR-020217, TRA0039720, OTAVA-BB 7020330573, NCGC00242250-01, AJ-13825, AK-47326, AN-13498, BC676800, BR-47326, SC-22386, SY003305, AB0008246, DB-021870, TR-020217, AM20060373, D1813, FT-0614257, ST24032531, ST50307282, TL80073590, MFCD00004333 (98%), C-4558, 807D307, I01-1435, W-105414, InChI=1/C8H6Cl2O2/c9-6-2-1-5(3-7(6)10)4-8(11)12/h1-3H,4H2,(H,11,12, C8H6Cl2O2, C8-H6-Cl2-O2, KST-1A6370, CID79874, AR-1A3825, 3,4-Dichlorophenylacetic acid, 99% - 100G 100g, 5977-93-5, 110704-34-2,

Complexity	172
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	203.974g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	205.034g/mol
Monoisotopic Mass	203.974g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

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

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