AG003EEF

41712-14-5 | 1H-Indene-2-carboxylic acid

AG003EEF

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CAS Number	41712-14-5
Catalog Number	AG003EEF(AGN-PC-03D1G4)
Chemical Name	1H-Indene-2-carboxylic acid
IUPAC Name	1H-indene-2-carboxylic acid
InChI	InChI=1S/C10H8O2/c11-10(12)9-5-7-3-1-2-4-8(7)6-9/h1-5H,6H2,(H,11,12)
InChI Key	BINGGEWUXWUXMJ-UHFFFAOYSA-N
MDL Number	MFCD00039586
Molecular Formula	C10H8O2
Molecular Weight	160.1693
SMILES	C1=CC=C2CC(=CC2=C1)C(=O)O
Synonyms	1H-Indene-2-carboxylic acid, 41712-14-5, Indene-2-carboxylic acid, BINGGEWUXWUXMJ-UHFFFAOYSA-N, 1H-Indene-2-carboxylicAcid, 2-indenecarboxylic acid, ACMC-209jlb, AC1LB32I, SCHEMBL1067727, CTK4I5163, KS-00000CWN, DTXSID40341747, ZINC2168371, 5744AB, ANW-29661, MFCD00039586, AKOS015840961, FCH1160781, TRA0074009, AJ-33856, CS-11557, SY024866, TR-036759, FT-0762376, MFCD00039586 (96%), B-2957, I04-2380, F0001-0849, InChI=1/C10H8O2/c11-10(12)9-5-7-3-1-2-4-8(7)6-9/h1-5H,6H2,(H,11,12, C10H8O2, CID575464,

Complexity	230
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	160.052g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	160.172g/mol
Monoisotopic Mass	160.052g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

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