3-Bromopropyl isocyanate

Modify Date: 2025-09-09 12:21:15

3-Bromopropyl isocyanate Structure
3-Bromopropyl isocyanate structure
 Common Name 3-Bromopropyl isocyanate
CAS Number 56017-72-2 Molecular Weight 164.00100
Density 1.47g/cm3 Boiling Point 174.6ºC at 760mmHg
Molecular Formula C4H6BrNO Melting Point N/A
MSDS N/A Flash Point 59.4ºC

 Names

Name 1-bromo-3-isocyanatopropane
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.47g/cm3
Boiling Point 174.6ºC at 760mmHg
Molecular Formula C4H6BrNO
Molecular Weight 164.00100
Flash Point 59.4ºC
Exact Mass 162.96300
PSA 29.43000
LogP 1.10720
Index of Refraction 1.496
InChIKey KMDXMJQBNOVBNE-UHFFFAOYSA-N
SMILES O=C=NCCCBr

 Synthetic Route

1-(5,6-dihydro-4H-[1,3]oxazin-2-yl)-pyridinium, toluene-4-sulfonate structure

1-(5,6-dihydro-...

CAS#:56017-71-1

~%

3-Bromopropyl isocyanate Structure

3-Bromopropyl i...

CAS#:56017-72-2

Literature: Krantz,A.; Hoppe,B. Tetrahedron Letters, 1975 , # 9 p. 695 - 698
4-Bromobutanoyl chloride structure

4-Bromobutanoyl...

CAS#:927-58-2

~%

3-Bromopropyl isocyanate Structure

3-Bromopropyl i...

CAS#:56017-72-2

Literature: Kricheldorf,H.R. Angewandte Chemie, 1979 , vol. 91, p. 749

 Synonyms

3-bromo-isocyanatopropane
Propane,1-bromo-3-isocyanato
3-Brom-propylisocyanat
3-Bromopropyl isocyanate
Y9470
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