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2-Bromododecane

2-Bromododecane structure

CAS No:
13187-99-0
Formula:
C12H25Br
Chemical Name:
2-Bromododecane
Synonyms:
Dodecane,2-bromo-;2-Bromododecane;1-Methylundecyl bromide;2-Dodecyl bromide;NSC 97571;α-Bromododecane;74069-66-2
Categories:
Organic Chemistry > Hydrocarbons and Derivatives

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2-Bromododecane Basic Attributes

Molecular Weight：

249.23

Exact Mass：

249.23

EC Number：

236-142-7

NSC Number：

97571

HScode：

2903399090

Characteristics

PSA：

XLogP3：

5.30060

Density：

1.02 g/mL at 25 °C(lit.)

Melting Point：

−96 °C(lit.)

Boiling Point：

125-130 °C @ Press: 10 Torr

Flash Point：

>230 °F

Refractive Index：

n 20/D 1.4555(lit.)

Vapor Pressure：

0.29 psi ( 20 °C)

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-37/39

Marks：

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:249.23
XLogP3:6.5
Rotatable Bond Count:9
Exact Mass:248.11396
Monoisotopic Mass:248.11396
Heavy Atom Count:13
Complexity:91.1
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes