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1,5-Pentanedithiol

1,5-Pentanedithiol structure

1,5-Pentanedithiol 

structure
  • CAS No:

    928-98-3

  • Formula:

    C5H12S2

  • Chemical Name:

    1,5-Pentanedithiol

  • Synonyms:

    1,5-Pentanedithiol;1,5-Dimercaptopentane;NSC 51699;1,5-Dithiolpentane

  • Categories:

    Chemical Reagents  >  Organic Reagents

Description

colourless liquid with a very unpleasant smell

1,5-Pentanedithiol Basic Attributes

136.28

136.28

1732335

213-194-9

R8RC3Q7T1W

51699

DTXSID40239150

29309070

Characteristics

2

2.27

Very slightly yellow liquid. With a stench.

1.0±0.1 g/cm3

−72 °C(lit.)

108-109 °C @ Press: 15 Torr

203 °F

1.501

Store below +30°C.

Safety Information

9

UN3334

3

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

36/37/39-26-36-9

Xn

Stable. Combustible. Incompatible with strong oxidizing agents, strong bases.

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P501

H302

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, and P501|Aggregated GHS information provided by 6 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:136.3
XLogP3:1.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:136.03804273
Monoisotopic Mass:136.03804273
Topological Polar Surface Area:2
Heavy Atom Count:7
Complexity:25.3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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