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4-Pentyne-1-thiol

4-Pentyne-1-thiol structure

CAS No:
77213-88-8
Formula:
C5H8S
Chemical Name:
4-Pentyne-1-thiol
Synonyms:
4-Pentyne-1-thiol (>90%);4-Pentyne-1-thiol (;pent-4-yne-1-thiol;4-Pentyne-1-thiol (>

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4-Pentyne-1-thiol Basic Attributes

Molecular Weight：

100.18

Exact Mass：

100.03467143

DSSTox ID：

DTXSID10504064

Characteristics

Density：

0.920±0.06 g/cm3

Boiling Point：

41 °C(Press: 15 Torr)

PKA：

10.11±0.10

4-Pentyne-1-thiol Use and Manufacturing

4-Pentyne-1-thiol is an acetylenic thiol used in Prostaglandin preparation.

Computed Properties

Molecular Weight:100.18
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:100.03467143
Monoisotopic Mass:100.03467143
Topological Polar Surface Area:1
Heavy Atom Count:6
Complexity:57.6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-Pentyne-1-thiol

Basic Attributes
Characteristics
Use and Manufacturing
Computed Properties

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