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3-Isocyanatobenzo[b]thiophene

3-Isocyanatobenzo[b]thiophene structure

CAS No:
321309-37-9
Formula:
C9H5NOS
Chemical Name:
3-Isocyanatobenzo[b]thiophene
Synonyms:
Benzo[b]thiophene,3-isocyanato-;3-Isocyanatobenzo[b]thiophene;Benzo[b]thiophen-3-yl isocyanate;3-Isocyanato-1-benzothiophene

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3-Isocyanatobenzo[b]thiophene Basic Attributes

Molecular Weight：

175.2071

Exact Mass：

175.21

DSSTox ID：

DTXSID50630371

HScode：

2934999090

Characteristics

PSA：

57.7

XLogP3：

2.86860

Safety Information

Transport codes：

2206

hazard class code：

23-36/37/38

safety instructions：

23-26-36/37/39

Computed Properties

Molecular Weight:175.21
XLogP3:3.9
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:175.00918496
Monoisotopic Mass:175.00918496
Topological Polar Surface Area:57.7
Heavy Atom Count:12
Complexity:213
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-Isocyanatobenzo[b]thiophene

Basic Attributes
Characteristics
Safety Information
Computed Properties

3-Isocyanatobenzo[b]thiophene

SDS

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