AG00IERI

87787-08-4 | 1,4-Dioxaspiro[4.5]decane-8-carboxylic acid, 8-methyl-, methyl ester

AG00IERI

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CAS Number	87787-08-4
Catalog Number	AG00IERI(AGN-PC-03RQVT)
Chemical Name	1,4-Dioxaspiro[4.5]decane-8-carboxylic acid, 8-methyl-, methyl ester
IUPAC Name	methyl 8-methyl-1,4-dioxaspiro[4.5]decane-8-carboxylate
InChI	InChI=1S/C11H18O4/c1-10(9(12)13-2)3-5-11(6-4-10)14-7-8-15-11/h3-8H2,1-2H3
InChI Key	GPFLQUDSOXRFIP-UHFFFAOYSA-N
MDL Number	MFCD22681691
Molecular Formula	C11H18O4
Molecular Weight	214.2582
SMILES	O=C(C(CC1)(C)CCC21OCCO2)OC
Synonyms	methyl 8-methyl-1,4-dioxaspiro[4.5]decane-8-carboxylate, 87787-08-4, SCHEMBL3198604, KS-00000RHB, DTXSID70626670, GPFLQUDSOXRFIP-UHFFFAOYSA-N, MFCD22681691, ZINC91352013, AKOS016845153, CS-W006959, DS-7103, RL05468, AK132856, AJ-130689, ST2407303, 4CH-005559, J-522581, methyl 4,4-ethylenedioxy-1-methylcyclohexanecarboxylate, methyl 8-methyl-1,4-dioxaspiro[4,5]decan-8-carboxylate, methyl 8-methyl-1,4-dioxaspiro[4.5]decan-8-carboxylate, methyl 8-methyl-1,4-dioxaspiro [4.5]decan-8-carboxylate, 1,4-Dioxaspiro[4.5]decane-8-carboxylic acid, 8-methyl-, methyl ester, Methyl8-methyl-1,4-dioxaspiro[4.5]decane-8-carboxylate,

Complexity	245
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	214.121g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	214.261g/mol
Monoisotopic Mass	214.121g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	44.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

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

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