Home Other Building Blocks 2-isocyanato-1,1-dimethoxypropane

2-isocyanato-1,1-dimethoxypropane

CAS No.:
886593-28-8
Catalog Number:
AG01EJZN
Molecular Formula:
C6H11NO3
Molecular Weight:
145.1564
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Product Description
Catalog Number:
AG01EJZN
Chemical Name:
2-isocyanato-1,1-dimethoxypropane
CAS Number:
886593-28-8
Molecular Formula:
C6H11NO3
Molecular Weight:
145.1564
MDL Number:
MFCD24452064
IUPAC Name:
2-isocyanato-1,1-dimethoxypropane
InChI:
InChI=1S/C6H11NO3/c1-5(7-4-8)6(9-2)10-3/h5-6H,1-3H3
InChI Key:
XSKPXLHSPIQLLU-UHFFFAOYSA-N
SMILES:
COC(C(N=C=O)C)OC
Properties
Complexity:
127  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.074g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
145.158g/mol
Monoisotopic Mass:
145.074g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
47.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties