AG000W69

1314398-25-8 | 2H-Pyran-4-methanol, tetrahydro-2,2,6,6-tetramethyl-

AG000W69

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CAS Number	1314398-25-8
Catalog Number	AG000W69(AGN-PC-0WD8NH)
Chemical Name	2H-Pyran-4-methanol, tetrahydro-2,2,6,6-tetramethyl-
IUPAC Name	(2,2,6,6-tetramethyloxan-4-yl)methanol
InChI	InChI=1S/C10H20O2/c1-9(2)5-8(7-11)6-10(3,4)12-9/h8,11H,5-7H2,1-4H3
InChI Key	CRUHQSBSNGCXBO-UHFFFAOYSA-N
MDL Number	MFCD20483314
Molecular Formula	C10H20O2
Molecular Weight	172.2646
SMILES	CC1(OC(C)(C)CC(CO)C1)C
Synonyms	1314398-25-8, (2,2,6,6-tetramethyloxan-4-yl)methanol, (2,2,6,6-tetramethyl-tetrahydro-2H-pyran-4-yl)methanol, (2,2,6,6-Tetramethyltetrahydro-2H-pyran-4-yl)methanol, SCHEMBL2223365, KS-000004OJ, MFCD20483314, ZINC118346502, SB12519, AS-51478, DA-12434, CS-0053544, FT-0717861, 2H-Pyran-4-methanol, tetrahydro-2,2,6,6-tetramethyl-,

Complexity	145
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	172.146g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	172.268g/mol
Monoisotopic Mass	172.146g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	29.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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