AG0037C9

51939-71-0 | 3,4-Dihydro-2H-1-benzopyran-2-carboxylic acid

AG0037C9

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CAS Number	51939-71-0
Catalog Number	AG0037C9(AGN-PC-0KJZY1)
Chemical Name	3,4-Dihydro-2H-1-benzopyran-2-carboxylic acid
IUPAC Name	3,4-dihydro-2H-chromene-2-carboxylic acid
InChI	InChI=1S/C10H10O3/c11-10(12)9-6-5-7-3-1-2-4-8(7)13-9/h1-4,9H,5-6H2,(H,11,12)
InChI Key	SFLFCQJQOIZMHF-UHFFFAOYSA-N
MDL Number	MFCD00044719
Molecular Formula	C10H10O3
Molecular Weight	178.1846
SMILES	O1C(CCC2=C1C=CC=C2)C(=O)O
Synonyms	Chromane-2-carboxylic acid, 51939-71-0, Chroman-2-carboxylic acid, 3,4-dihydro-2H-1-benzopyran-2-carboxylic acid, 3,4-dihydro-2H-chromene-2-carboxylic acid, 2H-1-BENZOPYRAN-2-CARBOXYLIC ACID, 3,4-DIHYDRO-, Maybridge4_000177, 2-carboxychroman, chroman carboxylic acid, PubChem14568, AC1MC3CF, 2-chroman-carboxylic acid, Chromane-2-carboxylic acid, SCHEMBL229558, CTK1G9143, DTXSID20369080, SFLFCQJQOIZMHF-UHFFFAOYSA-N, HMS1521I01, (+/-)-Chroman-2-carboxylic acid, KS-00000FX5, 7286AB, ANW-57775, CCG-55377, MFCD00044719, SBB053531, AKOS005208243, AB01988, chromane-2-carboxylic acid, AldrichCPR, MCULE-5579568884, IDI1_030759, AK-44050, AS-35515, SC-49135, AB1005431, DB-007357, TC-146520, 3,4-dihydro-1-benzopyran-2-carboxylic acid, CS-0038563, FT-0623780, ST50949670, 2,3-DIHYDRO-BENZPYRAN-2-CARBOXYLIC ACID, 3.4-dihydro-2H-1-benzopyran-2-carboxylic acid, 2H-1-Benzopyran-2-carboxylicacid, 3,4-dihydro-, A802726, A828857, I14-4597, SR-01000644403-1, (+)-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid, (-)-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid, F2108-0136, Z1954804056, null, (R)-chroman-2-carboxylic acid, (S)-chroman-2-carboxylic acid, CHROMANE-2-CARBOXYLICACID, C10H10O3, CID2723665, 83780-47-6, 1131-09-5, 83780-46-5,

Complexity	202
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	178.063g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	178.187g/mol
Monoisotopic Mass	178.063g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	46.5A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.9

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