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Home> Hot Product Listed T   > T6770538
9002-86-2 structure

T6770538

Iupac Name:chloroethene
CAS No.:9002-86-2
Molecular Weight:64.51410
Molecular Formula:C18H20FN3O4S (isomer)
Names and Identifiers
Synonyms

1-[({3-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl}carbamoyl)methyl]cyclohexane-1-carboxylic acid MCULE-7931043064 MOLPORT-009-087-026 Z735904740 ZINC55149387

Inchi
InChI=1S/C2H3Cl/c1-2-3/h2H,1H2
InChkey
BZHJMEDXRYGGRV-UHFFFAOYSA-N
Canonical Smiles
C=CCl
Properties
Melting Point
-153.8℃
Refractive Index
n20/D 1.3700(lit.)
Safety and Handling
Risk Statements
R45
Safety Statements
S45;S53
HazardClass
2.1
Hazard Note
H220; H280; H350
PackingGroup
O52
Transport
UN 1086 2.1
Reach Info
Globally, no enterprise has officially registered the substance REACH.
Other official information: ·ECHA Information Page for CAS: 9002-86-2 EC: T6770538 ·ECHA C&L Inventory for CAS: CAS: 9002-86-2 EC: T6770538
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Not classified.

2.2 GHS label elements, including precautionary statements

Pictogram(s) No symbol.
Signal word

No signal word.

Hazard statement(s)

none

Precautionary statement(s)
Prevention

none

Response

none

Storage

none

Disposal

none

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:64.51410g/mol
  • Molecular Formula:C18H20FN3O4S
  • Compound Is Canonicalized:True
  • Exact Mass:61.992
  • Monoisotopic Mass:61.992
  • Complexity:10.3
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:0
  • Topological Polar Surface Area:0A^2
  • Heavy Atom Count:3
  • 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
  • CACTVS Substructure Key Fingerprint: AAADcQBAAAAEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGAIAAAAAAAOAAEAAAAAAAACA AAACAAAAAAAAAAAIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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