Home Other Building Blocks 3-BROMOAZEPAN-2-ONE

3-BROMOAZEPAN-2-ONE

CAS No.:
3457-66-7
Catalog Number:
AG00CM6Q
Molecular Formula:
C6H10BrNO
Molecular Weight:
192.0537
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Product Description
Catalog Number:
AG00CM6Q
Chemical Name:
3-BROMOAZEPAN-2-ONE
CAS Number:
3457-66-7
Molecular Formula:
C6H10BrNO
Molecular Weight:
192.0537
MDL Number:
MFCD02683824
IUPAC Name:
3-bromoazepan-2-one
InChI:
InChI=1S/C6H10BrNO/c7-5-3-1-2-4-8-6(5)9/h5H,1-4H2,(H,8,9)
InChI Key:
ZOGNPJHCXKAYAJ-UHFFFAOYSA-N
SMILES:
O=C1NCCCCC1Br
Properties
Complexity:
116  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.995g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
192.056g/mol
Monoisotopic Mass:
190.995g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties