| SpectraBase Spectrum ID |
A2xKwTCSFLS |
| Name |
Butane, 1-isocyanato- |
| CAS Registry Number |
111-36-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C5H9NO |
| InChI |
InChI=1S/C5H9NO/c1-2-3-4-6-5-7/h2-4H2,1H3 |
| InChIKey |
HNHVTXYLRVGMHD-UHFFFAOYSA-N |
| Molecular Weight |
99.133 g/mol |
| SMILES |
CCCCN=C=O |
| SPLASH |
splash10-0006-9000000000-6b8d64d34fb0f005858f |
| Source of Spectrum |
HE-1982-0-0 |
| Synonyms |
1-Butyl isocyanate
1-Isocyanatobutane
BIC
Butyl isocyanate
Isocyanic acid n-butyl ester
Isocyanic acid, butyl ester
N-C4H9NCO
n-Butyl isocyanate
EINECS 203-862-8
HSDB 5548
UN2485 |
| Wiley ID |
1119093 |
