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6-Heptynenitrile

6-Heptynenitrile structure

CAS No:
15295-69-9
Formula:
C7H9N
Chemical Name:
6-Heptynenitrile
Synonyms:
hept-6-ynenitrile; 6-Cyano-1-hexyne;

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6-Heptynenitrile Basic Attributes

Molecular Weight：

107.15300

Exact Mass：

107.073499291

DSSTox ID：

DTXSID10472012

HScode：

2926909090

Characteristics

PSA：

23.79000

XLogP3：

1.70358

Density：

0.89

Boiling Point：

93ºC / 14mmHg

Flash Point：

78.206ºC

Refractive Index：

1.444

Vapor Pressure：

0.24mmHg at 25°C

Safety Information

GHS Classification：

|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P264, P270, P280, P301+P310, P302+P352, P305+P351+P338, P321, P330, P332+P313, P337+P313, P362, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:107.15
XLogP3:1.4
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:107.073499291
Monoisotopic Mass:107.073499291
Topological Polar Surface Area:23.8
Heavy Atom Count:8
Complexity:129
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 6-Heptynenitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties

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