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1H-Indole-3-thiol

1H-Indole-3-thiol structure

CAS No:
480-94-4
Formula:
C8H7NS
Chemical Name:
1H-Indole-3-thiol
Synonyms:
1H-Indole-3-thiol;Indole-3-thiol;3-Mercaptoindole;3-Sulfanylindole
Categories:
Organic Chemistry > Heterocyclic Ring

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Description

Crystalline Solid

1H-Indole-3-thiol Basic Attributes

Molecular Weight：

149.21300

Exact Mass：

149.21

DSSTox ID：

DTXSID90197392

HScode：

2933990090

Characteristics

PSA：

54.59000

XLogP3：

2.45660

Density：

1.303 g/cm3

Melting Point：

99-100 °C

Boiling Point：

326.6ºC at 760 mmHg

Flash Point：

151.3ºC

Refractive Index：

1.751

Safety Information

safety instructions：

Marks：

Xi: Irritant;

Computed Properties

Molecular Weight:149.21
XLogP3:2.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:1
Exact Mass:149.02992040
Monoisotopic Mass:149.02992040
Topological Polar Surface Area:16.8
Heavy Atom Count:10
Complexity:126
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes