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AG00GRGB

89-51-0 | Homophthalic Acid

AG00GRGB

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CAS Number	89-51-0
Catalog Number	AG00GRGB(AGN-PC-0JL7AO)
Chemical Name	Homophthalic Acid
EC Number	201-913-9
IUPAC Name	2-(carboxymethyl)benzoic acid
InChI	InChI=1S/C9H8O4/c10-8(11)5-6-3-1-2-4-7(6)9(12)13/h1-4H,5H2,(H,10,11)(H,12,13)
InChI Key	ZHQLTKAVLJKSKR-UHFFFAOYSA-N
MDL Number	MFCD00004326
Molecular Formula	C9H8O4
Molecular Weight	180.1574
SMILES	O=C(O)C1=CC=CC=C1CC(O)=O
Synonyms	homophthalic acid, Homophthalic acid, 89-51-0, 2-(Carboxymethyl)benzoic acid, Benzeneacetic acid, 2-carboxy-, 2-Carboxyphenylacetic acid, 2-Carboxybenzeneacetic acid, alpha-Carboxy-o-toluic acid, (o-Carboxymethyl)benzoic acid, (2-Carboxyphenyl)acetic acid, o-Toluic acid, alpha-carboxy-, Toluene-alpha,2-dicarboxylic acid, Homophthalic acid, 98%, EINECS 201-913-9, MFCD00004326, NSC 15185, BRN 1872069, 2-Carboxymethyl-benzoic acid, .alpha.-Carboxy-o-toluic acid, MLS000080552, o-Toluic acid, .alpha.-carboxy-, ZHQLTKAVLJKSKR-UHFFFAOYSA-N, Toluene-.alpha.,2-dicarboxylic acid, SMR000035334, Homophthalic acid (2-Carboxyphenylacetic acid), homopthalic acid, a-Carboxy-o-toluic acid, ChemDiv2_003450, 2-carboxymethylbenzoic acid, AC1L25TW, SCHEMBL27477, Phenacetic acid, 2-carboxy-, 4-09-00-03343 (Beilstein Handbook Reference), cid_66643, 2-(carboxymethyl)-benzoic acid, AC1Q74Z7, 2-(2-Carboxyphenyl)acetic acid, CHEMBL1229545, DTXSID4058990, BDBM33525, CTK7J2419, 2-(Carboxymethyl)benzoic acid #, HMS1378M18, HMS2404J09, ZINC265888, ACT04996, NSC15185, BBL010519, NSC-15185, NSC401692, SBB068822, STK720145, AKOS000118873, 2-(2-hydroxy-2-oxoethyl)benzoic acid, CCG-202892, FS-4160, MCULE-3233814444, NSC-401692, o-Toluic acid, alpha-carboxy- (8CI), AK-43206, AN-42468, K594, LS-28651, SC-62928, AB1008428, ST4133884, TR-028108, BB 0242413, EU-0099869, FT-0611655, KS-00000538, A-7231, AC-907/25014248, SR-01000597071, S01-0326, SR-01000597071-1, F0913-5457, Z256709182, 2-carboxy-benzeneaceticaci, (2-carboxyphenyl)eddikesyre, Homophthalic acid, 99% 25g, C9H8O4, C9-H8-O4, CID66643, Homophthalic acid, 98% - 5G 5g, ACN-050293, T0262, C-1900, \|A-Carboxy-o-toluic acid; 2-Carboxyphenylacetic acid, DIC,

Complexity	212
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	180.042g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	180.159g/mol
Monoisotopic Mass	180.042g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	74.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

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Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

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Reviewed by:Jessie

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Angene International Limited