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Home> Hot Product Listed T   > T6627161
3840-17-3 structure

T6627161

Iupac Name:1-chloro-3-prop-2-enylbenzene
CAS No.:3840-17-3
Molecular Weight:152.621
Molecular Formula:C19H26N4O2 (isomer)
Names and Identifiers
Synonyms

MCULE-1033283098 MOLPORT-009-177-897 n-(benzyloxy)-2-(6-fluoro-4-oxo-3,4-dihydroquinazolin-3-yl)acetamide Z336748196 ZINC48265649

Inchi
InChI=1S/C9H9Cl/c1-2-4-8-5-3-6-9(10)7-8/h2-3,5-7H,1,4H2
InChkey
UYLHDGQKBPNWQI-UHFFFAOYSA-N
Canonical Smiles
C=CCC1=CC(=CC=C1)Cl
Properties
Refractive Index
1.53
HS Code
2903999090
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:152.621g/mol
  • Molecular Formula:C19H26N4O2
  • Compound Is Canonicalized:True
  • XLogP3-AA:4
  • Exact Mass:152.039
  • Monoisotopic Mass:152.039
  • Complexity:109
  • Rotatable Bond Count:2
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:0
  • Heavy Atom Count:10
  • 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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