AG003FJ3

76429-73-7 | 2,3-Dihydrobenzofuran-5-carboxylic acid

AG003FJ3

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CAS Number	76429-73-7
Catalog Number	AG003FJ3(AGN-PC-0JUSQW)
Chemical Name	2,3-Dihydrobenzofuran-5-carboxylic acid
IUPAC Name	2,3-dihydro-1-benzofuran-5-carboxylic acid
InChI	InChI=1S/C9H8O3/c10-9(11)7-1-2-8-6(5-7)3-4-12-8/h1-2,5H,3-4H2,(H,10,11)
InChI Key	YXYOLVAXVPOIMA-UHFFFAOYSA-N
MDL Number	MFCD00085012
Molecular Formula	C9H8O3
Molecular Weight	164.1580
SMILES	C(=O)(O)c1cc2c(cc1)OCC2
Synonyms	76429-73-7, 2,3-Dihydrobenzofuran-5-Carboxylic Acid, 2,3-dihydrobenzo[b]furan-5-carboxylic acid, 2,3-dihydro-1-benzofuran-5-carboxylic acid, 2,3-Dihydrobenzo[b]furan-5-carboxylicacid, 5-Benzofurancarboxylic acid, 2,3-dihydro-, 2,3-dihydrobenzo(b)furan-5-carboxylic acid, PubChem9983, CDS1_000209, AC1LDWWZ, PubChem14824, Maybridge1_002497, AC1Q73UY, KSC377A5F, DivK1c_001249, SCHEMBL1395976, CTK2H7052, HMS548J11, ZINC39810, DTXSID10350321, YXYOLVAXVPOIMA-UHFFFAOYSA-N, dihydrobenzofuran-5-carboxylic acid, ACT01878, 5-Carboxy-2,3-dihydrobenzo[b]furan, ANW-47795, MFCD00085012, SBB005420, STL512713, AKOS000157507, AC-3153, MCULE-3044288133, MS-1996, QC-3612, RP02354, SDCCGMLS-0065906.P001, TRA0049852, TRA0065500, VF10224, 2,3-Dihydro-5-benzofurancarboxylic acid, 2,3-Dihydro-benzofuran-5-carboxylic acid, 2,3-dihydrobenzofurane-5-carboxylic acid, 5-Benzofurancarboxylicacid, 2,3-dihydro-, AJ-08910, AN-13255, BR-29517, EN002320, Q455, SC-25701, SY004077, AB0000116, AB1005532, DB-019756, ST2415677, TX-012890, FT-0609655, EN300-31557, MFCD00085012 (97+%), 429D737, A838698, I01-0235, W-203746, 2,3-dihydrobenzo[b]furan-5-carboxylic acid, AldrichCPR, null, 1-Benzofuran-5-carboxylic acid, C9H8O3, 2,3-dihydrobenzofuran-5-acetic acid, CID676583, ACN-039906, S-2055, 2,3-Dihydro-1-benzofuran-5-carboxylic acid, 97% - 1G 1g, 69999-16-2,

Complexity	190
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	164.047g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	164.16g/mol
Monoisotopic Mass	164.047g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	46.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P233-P260-P261-P264-P271-P280-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
UN Code

Certificate of Analysis

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