Home Other Building Blocks 1-(2,2-difluoroethyl)-1,4-diazepane hydrochloride

1-(2,2-difluoroethyl)-1,4-diazepane hydrochloride

CAS No.:
1427380-53-7
Catalog Number:
AG01A3P1
Molecular Formula:
C7H15ClF2N2
Molecular Weight:
200.6572
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Product Description
Catalog Number:
AG01A3P1
Chemical Name:
1-(2,2-difluoroethyl)-1,4-diazepane hydrochloride
CAS Number:
1427380-53-7
Molecular Formula:
C7H15ClF2N2
Molecular Weight:
200.6572
MDL Number:
MFCD23144050
IUPAC Name:
1-(2,2-difluoroethyl)-1,4-diazepane;hydrochloride
InChI:
InChI=1S/C7H14F2N2.ClH/c8-7(9)6-11-4-1-2-10-3-5-11;/h7,10H,1-6H2;1H
InChI Key:
HIJIVTPOWBMOOB-UHFFFAOYSA-N
SMILES:
FC(CN1CCNCCC1)F.Cl
Properties
Complexity:
109  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.089g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
200.658g/mol
Monoisotopic Mass:
200.089g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties