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7-Octyn-1-ol

7-Octyn-1-ol structure

CAS No:
871-91-0
Formula:
C8H14O
Chemical Name:
7-Octyn-1-ol
Synonyms:
7-Octyn-1-ol;8-Hydroxy-1-octyne;Oct-7-yne-1-ol;Oct-7-yn-1-ol
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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7-Octyn-1-ol Basic Attributes

Molecular Weight：

126.2

Exact Mass：

126.20

DSSTox ID：

DTXSID6061234

HScode：

2905290000

Characteristics

PSA：

20.2

XLogP3：

1.9

Density：

0.9±0.1 g/cm3

Melting Point：

-39°C (estimate)

Boiling Point：

191.5°C at 760 mmHg

Flash Point：

116.3±14.9 °C

Refractive Index：

1.455

Safety Information

Transport codes：

UN 1987

wgk germany：

hazard class code：

safety instructions：

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

7-Octyn-1-ol Use and Manufacturing

Uses

7-Octyn-1-ol is used in the synthesis of the sex pheromone of the citrus leafminer, Phyllocnistis citrella.

Manufacturing Info：

7-Octyn-1-ol: ACTIVE

Computed Properties

Molecular Weight:126.20
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:5
Exact Mass:126.104465066
Monoisotopic Mass:126.104465066
Topological Polar Surface Area:20.2
Heavy Atom Count:9
Complexity:88
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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7-OCTYN-1-OL

CAS No.: 871-91-0

Content: 99.00%

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