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Substance Name: 1-Butyne, 3-chloro-3-methyl-
RN: 1111-97-3
InChIKey: QSILYWCNPOLKPN-UHFFFAOYSA-N

Molecular Formula

  • C5-H7-Cl

Molecular Weight

  • 102.563
 
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Names and Synonyms

Synonyms

  • 3-Chloro-3-methyl-1-butyne
  • AI3-25133
  • EINECS 214-188-9
  • NSC 16173

Systematic Names

  • 1-Butyne, 3-chloro-3-methyl-
  • 3-Chloro-3-methylbut-1-yne

Registry Numbers

CAS Registry Number

  • 1111-97-3

System Generated Number

  • 0001111973

Structure Descriptors

InChI

1S/C5H7Cl/c1-4-5(2,3)6/h1H,2-3H3

InChIKey

QSILYWCNPOLKPN-UHFFFAOYSA-N

Smiles

C(#C)C(Cl)(C)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -6.10E+01 deg C   EXP
Boiling Point 76 deg C   EXP
log P (octanol-water) 2.170 (none)   EST
Atmospheric OH Rate Constant 7.27E-12 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.