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1,8-diisothiocyanatooctane

1,8-diisothiocyanatooctane structure

CAS No:
56312-14-2
Formula:
C10H16N2S2
Chemical Name:
1,8-diisothiocyanatooctane
Synonyms:
1,8-Octane diisothiocyanate;56312-14-2;1,8-Diisothiocyanatooctane;1,8-Octanediisothiocyanate;1,8-Diisothiocyanatooctane #;1,8-Octanediyldiisothiocyanate;SCHEMBL1999782;DTXSID70204856;C10H16N2S2;ZINC2390124;5695AE;GEO-02817;MFCD00041140;AKOS015898589;FT-0640372;A830996

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1,8-diisothiocyanatooctane Basic Attributes

Molecular Weight：

228.4 g/mol

Exact Mass：

228.07549087 g/mol

DSSTox ID：

DTXSID70204856

Characteristics

PSA：

88.9 Å²

Computed Properties

Molecular Weight:228.4
XLogP3:5.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:9
Exact Mass:228.07549087
Monoisotopic Mass:228.07549087
Topological Polar Surface Area:88.9
Heavy Atom Count:14
Complexity:192
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,8-diisothiocyanatooctane

Basic Attributes
Characteristics
Computed Properties

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