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(R)-(+)-1,2-Epoxytridecane

HCID 11264083
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Basic information

CAS
59829-81-1
Standard SMILES
CCCCCCCCCCC[C@@H]1CO1
InChIKey
ZKAPVLMBPUYKKP-CYBMUJFWSA-N
Molecular formula
C13H26O
Average molar mass
198.34 g/mol
Monoisotopic mass
198.19836545

Names & identifiers

Preferred name
(R)-(+)-1,2-Epoxytridecane
IUPAC
(2R)-2-undecyloxirane
English name
(R)-(+)-1,2-EPOXYTRIDECANE
Molecular formula
C13H26O
Molecular weight
198.34

Names & synonyms

(R)-(+)-1,2-Epoxytridecane59829-81-1RefChem:406952633-123-9(2R)-2-undecyloxirane(R)-2-undecyloxirane(r)-1,2-epoxytridecaneSCHEMBL9000260AKOS015913502(R)-(+)-1,2-Epoxytridecane, 97%I11471(r)-(+)-undecyloxirane
Show more names
Oxirane, 2-undecyl-, (2R)-

Database identifiers

CAS
59829-81-1
PubChem CID
11264083
EC Number
633-123-9
Nikkaji
J475.267H

Properties

Computed structural properties

XLogP
5.7
Topological polar surface area
12.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
10
Heavy atoms
14
Formal charge
0
Complexity
122

Physicochemical properties

Boiling point
138 °C15 · 138 °C15 mm Hg(lit.)
Density
0.841 g/mL · 0.841 g/mL at 25 °C(lit.)
refractive index
20 · n20/D 1.438(lit.)
Flash point
212 °F · 212 °F
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
319 · H319-H335-H315
Precautionary statements
264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Hazard Codes
Xi
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-36
WGK Germany
3 · 3

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

wgk
3
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
safety_code
26-36
Hazard statements
H319-H335-H315
Precautionary statements
P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P

Related reactions

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Compound notes

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