1-bromo-4-isocyanatobutane

Modify Date: 2025-09-29 18:47:26

1-bromo-4-isocyanatobutane Structure
1-bromo-4-isocyanatobutane structure
 Common Name 1-bromo-4-isocyanatobutane
CAS Number 71250-87-8 Molecular Weight 178.02700
Density N/A Boiling Point N/A
Molecular Formula C5H8BrNO Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 1-bromo-4-isocyanatobutane
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C5H8BrNO
Molecular Weight 178.02700
Exact Mass 176.97900
PSA 29.43000
LogP 1.49730
InChIKey VFDUCVKUHJTCGW-UHFFFAOYSA-N
SMILES O=C=NCCCCBr

 Synthetic Route

phosgene structure

phosgene

CAS#:75-44-5

4-Bromobutan-1-amine hydrobromide structure

4-Bromobutan-1-...

CAS#:24566-81-2

~89%

1-bromo-4-isocyanatobutane Structure

1-bromo-4-isocy...

CAS#:71250-87-8

Literature: Minin, Patricia L.; Walton, John C. Journal of Organic Chemistry, 2003 , vol. 68, # 7 p. 2960 - 2963
5-Bromopentanoyl chloride structure

5-Bromopentanoy...

CAS#:4509-90-4

~%

1-bromo-4-isocyanatobutane Structure

1-bromo-4-isocy...

CAS#:71250-87-8

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

 Synonyms

4-bromobutyl isocyanate
Butane,1-bromo-4-isocyanato
(4-Bromobutyl)-isocyanat
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