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1,2-diisothiocyanatobenzene

1,2-diisothiocyanatobenzene structure

CAS No:
71105-17-4
Formula:
C8H4N2S2
Chemical Name:
1,2-diisothiocyanatobenzene
Synonyms:
1,4-phenylenediisothiocyanate;bitoscanate;Jonit;L-6842;phenylene diisothiocyanate;1,2-Phenylene diisothiocyanate;71105-17-4;1,2-Diisothiocyanatobenzene;phenylene isothiocyanate;phenylene diisothiocyanate;SCHEMBL207554;1,2-Diisothiocyanatobenzene #;DTXSID10221320;ZINC2528086;8536AE;MFCD00060366;AKOS006344455;FT-0641328

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1,2-diisothiocyanatobenzene Basic Attributes

Molecular Weight：

192.3 g/mol

Exact Mass：

191.98159048 g/mol

DSSTox ID：

DTXSID10221320

Characteristics

PSA：

88.9 Å²

Drug Information

MeSH Entry Terms：

1,4-phenylenediisothiocyanate

Computed Properties

Molecular Weight:192.3
XLogP3:4.7
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:191.98159048
Monoisotopic Mass:191.98159048
Topological Polar Surface Area:88.9
Heavy Atom Count:12
Complexity:213
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,2-diisothiocyanatobenzene

Basic Attributes
Characteristics
Drug Information
Computed Properties

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