Home Other Building Blocks 3-isocyanatopropyl acetate

3-isocyanatopropyl acetate

CAS No.:
908108-71-4
Catalog Number:
AG01BXH2
Molecular Formula:
C6H9NO3
Molecular Weight:
143.1406
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Product Description
Catalog Number:
AG01BXH2
Chemical Name:
3-isocyanatopropyl acetate
CAS Number:
908108-71-4
Molecular Formula:
C6H9NO3
Molecular Weight:
143.1406
MDL Number:
MFCD30487802
IUPAC Name:
3-isocyanatopropyl acetate
InChI:
InChI=1S/C6H9NO3/c1-6(9)10-4-2-3-7-5-8/h2-4H2,1H3
InChI Key:
ZILVRKDYRLOKBJ-UHFFFAOYSA-N
SMILES:
O=C=NCCCOC(=O)C
Properties
Complexity:
149  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.058g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
143.142g/mol
Monoisotopic Mass:
143.058g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
55.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties