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2032-34-0 | Propanenitrile, 3,3-diethoxy-
CAS No: 2032-34-0 Catalog No: AG0028Q4 MDL No:MFCD00040558
Product Description
Catalog Number:
AG0028Q4
Chemical Name:
Propanenitrile, 3,3-diethoxy-
CAS Number:
2032-34-0
Molecular Formula:
C7H13NO2
Molecular Weight:
143.1836
MDL Number:
MFCD00040558
IUPAC Name:
3,3-diethoxypropanenitrile
InChI:
InChI=1S/C7H13NO2/c1-3-9-7(5-6-8)10-4-2/h7H,3-5H2,1-2H3
InChI Key:
WBOXEOCWOCJQNK-UHFFFAOYSA-N
SMILES:
CCOC(CC#N)OCC
EC Number:
217-988-6
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.095g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
143.186g/mol
Monoisotopic Mass:
143.095g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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