Home Nitriles 2-Ethyl-2-(hydroxymethyl)butanenitrile

2-Ethyl-2-(hydroxymethyl)butanenitrile

CAS No.:
1306738-95-3
Catalog Number:
AG01C41P
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01C41P
Chemical Name:
2-Ethyl-2-(hydroxymethyl)butanenitrile
CAS Number:
1306738-95-3
MDL Number:
MFCD19103513
IUPAC Name:
2-ethyl-2-(hydroxymethyl)butanenitrile
InChI:
InChI=1S/C7H13NO/c1-3-7(4-2,5-8)6-9/h9H,3-4,6H2,1-2H3
InChI Key:
XEMQORBDHXNOHM-UHFFFAOYSA-N
Properties
Complexity:
118  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.1g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
127.187g/mol
Monoisotopic Mass:
127.1g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties