Home Halogens N-[-4-chlorobut-2-en-1-yl]-2,2-dimethylpropanamide

N-[-4-chlorobut-2-en-1-yl]-2,2-dimethylpropanamide

CAS No.:
1562358-53-5
Catalog Number:
AG01DVOC
Molecular Formula:
C9H16ClNO
Molecular Weight:
189.6824
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01DVOC
Chemical Name:
N-[-4-chlorobut-2-en-1-yl]-2,2-dimethylpropanamide
CAS Number:
1562358-53-5
Molecular Formula:
C9H16ClNO
Molecular Weight:
189.6824
MDL Number:
MFCD24106073
IUPAC Name:
N-[(E)-4-chlorobut-2-enyl]-2,2-dimethylpropanamide
InChI:
InChI=1S/C9H16ClNO/c1-9(2,3)8(12)11-7-5-4-6-10/h4-5H,6-7H2,1-3H3,(H,11,12)/b5-4+
InChI Key:
FWBJTFIKFJVVDS-SNAWJCMRSA-N
SMILES:
ClCC=CCNC(=O)C(C)(C)C
Properties
Complexity:
170  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
189.092g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.683g/mol
Monoisotopic Mass:
189.092g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties