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Structure

1,2-Phenylene diisothiocyanate

CAS
71105-17-4
Catalog Number
ACM71105174
Category
Other Products
Molecular Weight
192.26
Molecular Formula
C8H4N2S2

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Specification

Synonyms
1,2-Diisothiocyanatobenzene, 1,2-Phenylene diisothiocyanate, MolPort-002-497-953, CID144459, 71105-17-4
IUPAC Name
1,2-diisothiocyanatobenzene
Canonical SMILES
C1=CC=C(C(=C1)N=C=S)N=C=S
InChI Key
RPFLVLIPBDQGAQ-UHFFFAOYSA-N
Boiling Point
346.9ºC at 760 mmHg
Melting Point
56ºC
Flash Point
172.5ºC
Density
1.2g/cm³
Exact Mass
191.98200
H-Bond Acceptor
2
H-Bond Donor
0
Safety Description
26-36/37/39
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