AG0016C3

1218915-91-3 | 2-Furancarboxylic acid, tetrahydro-2-methyl-, methyl ester

AG0016C3

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CAS Number	1218915-91-3
Catalog Number	AG0016C3(AGN-PC-09TQ8G)
Chemical Name	2-Furancarboxylic acid, tetrahydro-2-methyl-, methyl ester
IUPAC Name	methyl 2-methyloxolane-2-carboxylate
InChI	InChI=1S/C7H12O3/c1-7(6(8)9-2)4-3-5-10-7/h3-5H2,1-2H3
InChI Key	CWJSQEOFZMFXDO-UHFFFAOYSA-N
MDL Number	MFCD18651757
Molecular Formula	C7H12O3
Molecular Weight	144.1684
SMILES	COC(=O)C1(C)CCCO1
Synonyms	Methyl 2-Methyltetrahydrofuran-2-carboxylate, 1218915-91-3, METHYL 2-METHYLOXOLANE-2-CARBOXYLATE, SCHEMBL2185550, DTXSID10704885, CWJSQEOFZMFXDO-UHFFFAOYSA-N, KS-000007FV, 6969AJ, MFCD18651757, AKOS006366867, PB30335, AC-23580, SY013677, DB-061990, TC-308450, CS-0049156, FT-0710474, methyl 2-methyltetrahydro-2-furancarboxylate, MFCD18651757 (95%), (2S,4R)-4-Fluoropyrrolidine-2-carboxylicacid, Q-1278, 2-Furancarboxylic acid, tetrahydro-2-methyl-, methyl ester, TETRAHYDRO-2-METHYL-2-FURANCARBOXYLIC ACID METHYL ESTER, C7H12O3, 2524-67-6,

Complexity	144
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	144.079g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	144.17g/mol
Monoisotopic Mass	144.079g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	35.5A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H226-H302-H315-H318-H335
Packing Group	Ⅲ
Precautionary statements	P261-P280-P305+P351+P338
UN Code	UN 3272

Certificate of Analysis

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