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Structure

Cyclohexanecarbonyl isothiocyanate

CAS
27699-51-0
Catalog Number
ACM27699510
Category
Other Products
Molecular Weight
169.244040 [g/mol]
Molecular Formula
C8H11NOS

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Specification

Synonyms
cyclohexanecarbonyl isothiocyanate, 27699-51-0, AC1ODU26, AC1Q5JW4, CTK1A3586, MolPort-002-470-461, ZINC57211598, AKOS009031149, AG-E-88464, Cyclohexanecarbonylisothiocyanate (9CI), MCULE-3947730285, EN300-21044, T5786673, Benzoicacid, anhydride with isothiocyanic acid (6CI,7CI,8CI);Isothiocyanic acid,anhydride with benzoic acid (8CI);Benzoylthiocarbimide;N-Benzoylisothiocyanate;NSC 29259;
IUPAC Name
cyclohexanecarbonyl isothiocyanate
Canonical SMILES
C1CCC(CC1)C(=O)N=C=S
InChI Key
WSAOMDFBTKKMJA-UHFFFAOYSA-N
Boiling Point
248.4ºC at 760mmHg
Flash Point
104ºC
Density
1.18g/cm³
Exact Mass
169.05600
H-Bond Acceptor
2
H-Bond Donor
0
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