126-98-7,MFCD00001872
Catalog No.:AA000QLM

126-98-7 | 2-Propenenitrile, 2-methyl-

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  • Properties
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Technical Information
Catalog Number:
AA000QLM
Chemical Name:
2-Propenenitrile, 2-methyl-
CAS Number:
126-98-7
Molecular Formula:
C4H5N
Molecular Weight:
67.0892
MDL Number:
MFCD00001872
SMILES:
CC(=C)C#N
UN Number:
3079
Properties
Computed Properties
 
Complexity:
83.1  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
5  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
0  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
0.7  

Literature
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SDS
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Tags:126-98-7 Molecular Formula|126-98-7 MDL|126-98-7 SMILES|126-98-7 2-Propenenitrile, 2-methyl-
Catalog No.: AA000QLM
126-98-7,MFCD00001872
126-98-7 | 2-Propenenitrile, 2-methyl-
This product is typically in stock,please click "Inquire" below or contact us at [email protected]for pricing and availability information.
Inquire
Technical Information
Catalog Number: AA000QLM
Chemical Name: 2-Propenenitrile, 2-methyl-
CAS Number: 126-98-7
Molecular Formula: C4H5N
Molecular Weight: 67.0892
MDL Number: MFCD00001872
SMILES: CC(=C)C#N
UN Number: 3079
Properties
Complexity: 83.1  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 5  
Hydrogen Bond Acceptor Count: 1  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 0  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 0.7  
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