AG001CJ7

14049-11-7 | 2H-Pyran-3-ol, 6-ethenyltetrahydro-2,2,6-trimethyl-

AG001CJ7

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CAS Number	14049-11-7
Catalog Number	AG001CJ7(AGN-PC-0JKISF)
Chemical Name	2H-Pyran-3-ol, 6-ethenyltetrahydro-2,2,6-trimethyl-
EC Number	237-889-1
FEMA Number	4593
IUPAC Name	6-ethenyl-2,2,6-trimethyloxan-3-ol
InChI	InChI=1S/C10H18O2/c1-5-10(4)7-6-8(11)9(2,3)12-10/h5,8,11H,1,6-7H2,2-4H3
InChI Key	BCTBAGTXFYWYMW-UHFFFAOYSA-N
MDL Number	MFCD06200770
Molecular Formula	C10H18O2
Molecular Weight	170.2487
SMILES	OC1C(C)(C)OC(C=C)(C)CC1
Synonyms	14049-11-7, 2,2,6-Trimethyl-6-vinyltetrahydro-2H-pyran-3-ol, 6-ethenyl-2,2,6-trimethyloxan-3-ol, 2H-Pyran-3-ol, 6-ethenyltetrahydro-2,2,6-trimethyl-, Epoxylinalol, 2,2,6-Trimethyl-6-vinyltetrahydropyran-3-ol, 3-Hydroxy-2,2,6-trimethyl-6-vinyltetrahydropyran, Cnidiol C, 2H-Pyran-3-ol, tetrahydro-2,2,6-trimethyl-6-vinyl-, Linalool oxide pyranoside, linalool oxide (pyranoid), Tetrahydro-2,2,6-trimethyl-6-vinyl-2H-pyran-3-ol, 2H-Pyran-3-ol, 6-ethenyl-tetrahydro-2,2,6-trimethyl-, 2,6,6-trimethyl-2-vinyl-5-hydroxytetrahydropyran, 2,2,6-Trimethyl-6-vinyltetrahydropyran-3-ol (mixture of isomers), Linalool oxide I (pyranoid), Linalool oxide pyranoid, (+/-)-, EINECS 237-889-1, Linalool Oxide Pyranoid, ACMC-1CAQ6, AC1L1B1U, Linalool oxide II (pyranoid), SCHEMBL309187, CTK8B2928, BCTBAGTXFYWYMW-UHFFFAOYSA-N, ANW-41357, MFCD06200770, AKOS006281160, AN-19246, TR-005260, 2,2,6-trimethyl-6-vinyl-tetrahydropyran-3-ol, J-007398, 6-Ethenyl-tetrahydro-2,2,6-trimethyl-2H-Pyran-3-ol, 6-Ethenyltetrahydro-2,2,6-trimethyl-2H-Pyran-3-ol, I14-108392, 6-ethenyltetrahydro-2,2,6-trimethyl-2h-pyran-3(4h)-one, 2,2,6-Trimethyl-6-vinyltetrahydro-2H-pyran-3-ol, AldrichCPR, 6-Ethenyl-3,4,5,6-tetrahydro-2,2,6-trimethyl-2H-pyran-3-ol, linalool oxide C (2,6,6-trimethyl-2-vinyl-5-hydroxytetrahydropyran), Linalool oxide, Linalool 3,7-oxide, UNII-CJQ633A12A, CJQ633A12A, C10H18O2, CID26396, C10-H18-O2, T2605,

Complexity	186
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	170.131g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	170.252g/mol
Monoisotopic Mass	170.131g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	29.5A^2
Undefined Atom Stereocenter Count	2
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319
Packing Group
Precautionary statements	P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
UN Code

Certificate of Analysis

Lot Number