Home Other Building Blocks 1-(3,4-difluorophenyl)-1,4-diazepane

1-(3,4-difluorophenyl)-1,4-diazepane

CAS No.:
868064-74-8
Catalog Number:
AG01B9EF
Molecular Formula:
C11H14F2N2
Molecular Weight:
212.2391
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Product Description
Catalog Number:
AG01B9EF
Chemical Name:
1-(3,4-difluorophenyl)-1,4-diazepane
CAS Number:
868064-74-8
Molecular Formula:
C11H14F2N2
Molecular Weight:
212.2391
MDL Number:
MFCD14696085
IUPAC Name:
1-(3,4-difluorophenyl)-1,4-diazepane
InChI:
InChI=1S/C11H14F2N2/c12-10-3-2-9(8-11(10)13)15-6-1-4-14-5-7-15/h2-3,8,14H,1,4-7H2
InChI Key:
XULKFPPPSRQKJA-UHFFFAOYSA-N
SMILES:
Fc1cc(ccc1F)N1CCNCCC1
Properties
Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.113g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
212.244g/mol
Monoisotopic Mass:
212.113g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties