(R)-1,2-Pentanediol - CAS 108340-61-0

Catalog:	BB002257
Product Name:	(R)-1,2-Pentanediol
CAS:	108340-61-0
Synonyms:	pentane-1,2-diol; pentane-1,2-diol

Technical Data

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Literatures

Computed Properties

IUPAC Name:	(2R)-pentane-1,2-diol
Description:	(R)-1,2-Pentanediol (CAS# 108340-61-0 ) is a useful research chemical.
Molecular Weight:	104.15
Molecular Formula:	C5H12O2
Canonical SMILES:	CCCC(CO)O
InChI:	InChI=1S/C5H12O2/c1-2-3-5(7)4-6/h5-7H,2-4H2,1H3
InChI Key:	WCVRQHFDJLLWFE-UHFFFAOYSA-N
LogP:	0.13970

Publication Number	Title	Priority Date
FR-3098111-A1	CONCENTRATED COSMETIC FORMULATION BASE	20200707
WO-2021208962-A1	Coating composition, use and methods for making a substrate frost resistant	20200415
WO-2021204634-A1	Topical pharmaceutical composition in the form of an aqueous gel comprising at least amitriptyline	20200406
WO-2021198525-A1	(s,z)-3,7-dimethylnon-6-en-1-ol and its use as fragrance	20200402
US-11007134-B1	Ceramide containing capsules, ceramide compositions, and cosmetic compositions thereof	20200331

PMID	Publication Date	Title	Journal
23064773	20120901	Safety assessment of 1,2-glycols as used in cosmetics	International journal of toxicology
22296970	20120515	Binary VOCs absorption in a rotating packed bed with blade packings	Journal of environmental management
22440262	20120507	In vitro and in vivo immunomodulatory activities of iridoids fraction from Barleria prionitis Linn	Journal of ethnopharmacology
22890441	20120101	Dermal peptide delivery using enhancer molecules and colloidal carrier systems--part I: carnosine	Skin pharmacology and physiology
21585401	20111001	The influence of alkane chain length on the skin irritation potential of 1,2-alkanediols	International journal of cosmetic science

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Complexity:	37.1
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	104.083729621
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	104.083729621
Rotatable Bond Count:	3
Topological Polar Surface Area:	40.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.2