Home Nitriles 4-(methoxymethyl)oxane-4-carbonitrile

4-(methoxymethyl)oxane-4-carbonitrile

CAS No.:
1268154-09-1
Catalog Number:
AG01AM3I
Molecular Formula:
C8H13NO2
Molecular Weight:
155.1943
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Product Description
Catalog Number:
AG01AM3I
Chemical Name:
4-(methoxymethyl)oxane-4-carbonitrile
CAS Number:
1268154-09-1
Molecular Formula:
C8H13NO2
Molecular Weight:
155.1943
MDL Number:
MFCD19374474
IUPAC Name:
4-(methoxymethyl)oxane-4-carbonitrile
InChI:
InChI=1S/C8H13NO2/c1-10-7-8(6-9)2-4-11-5-3-8/h2-5,7H2,1H3
InChI Key:
SNBIDSKNHGWDCS-UHFFFAOYSA-N
SMILES:
COCC1(CCOCC1)C#N
Properties
Complexity:
164  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.095g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
155.197g/mol
Monoisotopic Mass:
155.095g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties