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2-Octynal

2-Octynal structure

CAS No:
1846-68-0
Formula:
C8H12O
Chemical Name:
2-Octynal
Synonyms:
2-Octynal;Oct-2-ynal

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2-Octynal Basic Attributes

Molecular Weight：

124.18 g/mol

Exact Mass：

124.18

EC Number：

217-427-5

DSSTox ID：

DTXSID10171593

Characteristics

PSA：

17.1 Å²

Boiling Point：

74-76 °C @ Press: 15 Torr

Safety Information

GHS Classification：

|Warning|H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]|P261, P272, P273, P280, P302+P352, P321, P333+P313, P363, P391, 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:124.18
XLogP3:2.8
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:124.088815002
Monoisotopic Mass:124.088815002
Topological Polar Surface Area:17.1
Heavy Atom Count:9
Complexity:124
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Octynal

Basic Attributes
Characteristics
Safety Information
Computed Properties

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