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Home> Encyclopedia > Hot Product Listed 5   > 5,9-Hexadecadiyne,16-chloro-
10558-44-8 structure

5,9-Hexadecadiyne,16-chloro-

Iupac Name:N-(dithiophen-2-ylmethylidene)hydroxylamine
CAS No.:10558-44-8
Molecular Weight:209.28798
Molecular Formula:C15H15N (isomer)
Names and Identifiers
Synonyms

16-chloro-5,9-hexadecadiyne 16-chlorohexadeca-5,9-diyne 5,9-hexadecadiyne, 16-chloro- AC1L3REN AC1Q3UM4 DTXSID0069250

Inchi
InChI=1/C9H7NOS2/c11-10-9(7-3-1-5-12-7)8-4-2-6-13-8/h1-6,11H
Canonical Smiles
C1=CSC(=C1)C(=NO)C2=CC=CS2
Properties
Density
1.55
Melting Point
125℃
Boiling Point
°Cat760mmHg
Vapour
7.58E-06mmHg at 25°C
Refractive Index
1.698
Flash Point
178.1°C
HS Code
2934999090
Safety and Handling
Risk Statements
R36/37/38
Safety Statements
S26;S37/39
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s) no data available
Signal word

no data available

Hazard statement(s)

no data available

Precautionary statement(s)
Prevention

no data available

Response

no data available

Storage

no data available

Disposal

no data available

2.3 Other hazards which do not result in classification

no data available

Computational chemical data
  • Molecular Weight:209.28798g/mol
  • Molecular Formula:C15H15N
  • Exact Mass:208.996905
  • Monoisotopic Mass:208.996905
  • Complexity:190
  • Rotatable Bond Count:2
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:4
  • Topological Polar Surface Area:89.1
  • Heavy Atom Count:13
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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Recommended Suppliers
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