AG007IE6

32936-76-8 | 1-Methylcyclobutanecarboxylic acid

AG007IE6

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CAS Number	32936-76-8
Catalog Number	AG007IE6(AGN-PC-0NK5JH)
Chemical Name	1-Methylcyclobutanecarboxylic acid
IUPAC Name	1-methylcyclobutane-1-carboxylic acid
InChI	InChI=1S/C6H10O2/c1-6(5(7)8)3-2-4-6/h2-4H2,1H3,(H,7,8)
InChI Key	GCZGQVRHZLOCDD-UHFFFAOYSA-N
MDL Number	MFCD15527494
Molecular Formula	C6H10O2
Molecular Weight	114.1424
SMILES	CC1(CCC1)C(=O)O
Synonyms	1-METHYLCYCLOBUTANECARBOXYLIC ACID, 32936-76-8, 1-methylcyclobutane-1-carboxylic acid, 1-methyl-cyclobutanecarboxylic acid, Cyclobutanecarboxylic acid, 1-methyl-, SCHEMBL264769, CTK8B8619, DTXSID60509084, GCZGQVRHZLOCDD-UHFFFAOYSA-N, 1-methylcyclobutane carboxylic acid, ANW-60913, MFCD15527494, ZINC39279501, 1-methyl-1-cyclobutanecarboxylic acid, AKOS006376243, CS-W005411, MCULE-8539228760, PB11149, AJ-99605, AK-78655, DS-17490, SC-25545, SY042151, AB0065105, DB-068720, TC-149658, 4CH-011259, FT-0698244, ST24021358, Z4598, MFCD15527494 (95%), Q-1318, 936M768, A821525, F8880-7654, Z1359429503, C6H10O2,

Complexity	114
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	114.068g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	114.144g/mol
Monoisotopic Mass	114.068g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code	UN 3265

Certificate of Analysis

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