Dihydrophytol - CAS 645-72-7

Catalog:	BB067621
Product Name:	Dihydrophytol
CAS:	645-72-7
Synonyms:	3,7,11,15-Tetramethyl-1-hexadecanol; 3,7,11,15-Tetramethylhexadecanol; Octahydrogeranylgeraniol; Phytanic Alcohol

Technical Data

IUPAC Name:	3,7,11,15-tetramethylhexadecan-1-ol
Description:	Dihydrophytol is an intermediate in the synthesis of Phytane (P399005). Phytane is a useful intermediate, which is involved in the manufacturing and analysis of various compounds. Phytane has recently been used in the development of a stable and environmental-friendly lubricating oil.
Molecular Weight:	298.55
Molecular Formula:	C20H42O
Canonical SMILES:	CC(C)CCCC(C)CCCC(C)CCCC(C)CCO
InChI:	InChI=1S/C20H42O/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-21/h17-21H,6-16H2,1-5H3
InChI Key:	AJAKLDUGVSKVDG-UHFFFAOYSA-N
Solubility:	Chloroform (Slightly), Dichloromethane (Slightly)
Appearance:	Colourless Oil
Storage:	4°C
References:	Qiao, H.; Yang, Y. Faming Zhuanli Shenqing 5pp. Patent 2017 CODEN:CNXXEV.

Complexity:	212
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	298.323565959
Formal Charge:	0
Heavy Atom Count:	21
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	298.323565959
Rotatable Bond Count:	14
Topological Polar Surface Area:	20.2Å²
Undefined Atom Stereocenter Count:	3
Undefined Bond Stereocenter Count:	0
XLogP3:	8.5