AG00C69K

39891-55-9 | 3-BENZOFURANCARBOXYLIC ACID, 2,3-DIHYDRO-

AG00C69K

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CAS Number	39891-55-9
Catalog Number	AG00C69K(AGN-PC-0HHIFY)
Chemical Name	3-BENZOFURANCARBOXYLIC ACID, 2,3-DIHYDRO-
IUPAC Name	2,3-dihydro-1-benzofuran-3-carboxylic acid
InChI	InChI=1S/C9H8O3/c10-9(11)7-5-12-8-4-2-1-3-6(7)8/h1-4,7H,5H2,(H,10,11)
InChI Key	RBIFJUFOAYMXFE-UHFFFAOYSA-N
MDL Number	MFCD08669486
Molecular Formula	C9H8O3
Molecular Weight	164.1580
SMILES	O1CC(C2=C1C=CC=C2)C(=O)O
Synonyms	39891-55-9, 2,3-Dihydrobenzofuran-3-carboxylic acid, 2,3-Dihydro-1-benzofuran-3-carboxylic acid, 3-Benzofurancarboxylic acid, 2,3-dihydro-, 2,3-Dihydro-3-benzofurancarboxylic acid, AC1LBQBR, SCHEMBL1504617, DTXSID50340201, RBIFJUFOAYMXFE-UHFFFAOYSA-N, 5259AB, ANW-75280, MFCD08669486, AKOS006239290, AB45862, ACN-025246, MCULE-6837281844, NE49655, BS-13700, TC-164025, 2,3-Dihydro-3-benzo[b]furancarboxylic acid, EN300-58952, 2,3-Dihydro-1-benzofuran-3-carboxylic acid #, F8880-3497, Z1259041014, C9H8O3, CID562423, 3-BENZOFURANCARBOXYLICACID,2,3-DIHYDRO-,

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	1
Undefined Bond Stereocenter Count	0
XLogP3	1.2

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