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1,16-Hexadecanediol

1,16-Hexadecanediol structure

CAS No:
7735-42-4
Formula:
C16H34O2
Chemical Name:
1,16-Hexadecanediol
Synonyms:
1,16-Hexadecanediol;1,16-Dihydroxyhexadecane
Categories:
Organic Chemistry > Coordination Complexes

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1,16-Hexadecanediol Basic Attributes

Molecular Weight：

258.446

Exact Mass：

258.44

EC Number：

231-794-9

UNII：

Z799LHM79S

DSSTox ID：

DTXSID7064788

Characteristics

PSA：

40.5

XLogP3：

5.25

Density：

0.9±0.1 g/cm3

Melting Point：

91.2-91.5 °C

Boiling Point：

197.9 °C @ Press: 3 Torr

Flash Point：

164.9±13.6 °C

Refractive Index：

1.463

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

R38

safety instructions：

S36/37

Marks：

Precautionary statement(s)：

P264, P280, P302+P352, P321, P332+P313, P362

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P321, P332+P313, and P362|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.

1,16-Hexadecanediol Use and Manufacturing

Manufacturing Info：

1,16-Hexadecanediol: INACTIVE

Computed Properties

Molecular Weight:258.44
XLogP3:5.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:15
Exact Mass:258.255880323
Monoisotopic Mass:258.255880323
Topological Polar Surface Area:40.5
Heavy Atom Count:18
Complexity:121
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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