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7-Bromoheptanenitrile

7-Bromoheptanenitrile structure

CAS No:
20965-27-9
Formula:
C7H12BrN
Chemical Name:
7-Bromoheptanenitrile
Synonyms:
Heptanenitrile,7-bromo-;7-Bromoheptanenitrile;6-Cyanohexyl bromide;7-Bromoheptanonitrile;NSC 60131

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Description

clear yellow to yellow-brown liquid

7-Bromoheptanenitrile Basic Attributes

Molecular Weight：

190.08

Exact Mass：

190.08

BRN：

1748070

EC Number：

244-128-7

NSC Number：

60131

DSSTox ID：

DTXSID5066667

HScode：

29269095

Characteristics

PSA：

23.8

XLogP3：

2.07

Appearance：

clear yellow to yellow-brown liquid

Density：

1.3±0.1 g/cm3

Boiling Point：

140-141 °C @ Press: 14 Torr

Flash Point：

>230 °F

Refractive Index：

1.471

Storage Conditions：

Store below +30°C.

Vapor Pressure：

0.012mmHg at 25°C

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

3276

wgk germany：

hazard class code：

22-43-36/37/38-20/21/22

safety instructions：

26-36/37-36/37/39

Marks：

Xn,Xi

Stability/Shelf Life：

Stable at room temperature in closed containers under normal storage and handling conditions.

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 42 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

7-Bromoheptanenitrile Use and Manufacturing

Manufacturing Info：

Heptanenitrile, 7-bromo-: ACTIVE

Computed Properties

Molecular Weight:190.08
XLogP3:2.3
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:5
Exact Mass:189.01531
Monoisotopic Mass:189.01531
Topological Polar Surface Area:23.8
Heavy Atom Count:9
Complexity:92.3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 7-Bromoheptanenitrile

Description
Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties

7-Bromoheptanenitrile

SDS

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