AG002K4P

209256-40-6 | 2,3-Dihydrobenzofuran-4-carboxylic acid

AG002K4P

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CAS Number	209256-40-6
Catalog Number	AG002K4P(AGN-PC-022HPK)
Chemical Name	2,3-Dihydrobenzofuran-4-carboxylic acid
IUPAC Name	2,3-dihydro-1-benzofuran-4-carboxylic acid
InChI	InChI=1S/C9H8O3/c10-9(11)7-2-1-3-8-6(7)4-5-12-8/h1-3H,4-5H2,(H,10,11)
InChI Key	CHDSHBWEGSCEDX-UHFFFAOYSA-N
MDL Number	MFCD10000604
Molecular Formula	C9H8O3
Molecular Weight	164.1580
SMILES	O1CCC=2C1=CC=CC2C(=O)O
Synonyms	2,3-dihydrobenzofuran-4-carboxylic acid, 209256-40-6, 2,3-Dihydro-1-benzofuran-4-carboxylic acid, 2,3-dihydro-benzofuran-4-carboxylic acid, 4-Benzofurancarboxylicacid, 2,3-dihydro-, 2,3-dihydrobenzofuran-4-carboxylicacid, SCHEMBL496918, DTXSID10596267, CHDSHBWEGSCEDX-UHFFFAOYSA-N, BCP15796, 0700AB, ANW-75273, ZINC40448430, AKOS006304981, 2,3-Dihydro-4-benzofurancarboxylic Acid, SC-43524, 2,3-dihydro-benzo furan-4-carboxylic acid, 4-Benzofurancarboxylic acid, 2,3-dihydro-, AB0048148, AJ-102718, TC-071930, 2,3-Dihydrobenzo[b]furan-4-carboxylic acid, 4CH-005841, FT-0645999, ST24038545, A25668, Z-7476, I14-3029, J-013719, C9H8O3, ACN-039649,

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	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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