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1343056-10-9

1343056-10-9 | 1-(cyclopropanesulfonyl)-1,4-diazepane

CAS No: 1343056-10-9 Catalog No: AG01B97X MDL No:MFCD20352038

Product Description

Catalog Number:
AG01B97X
Chemical Name:
1-(cyclopropanesulfonyl)-1,4-diazepane
CAS Number:
1343056-10-9
Molecular Formula:
C8H16N2O2S
Molecular Weight:
204.2898
MDL Number:
MFCD20352038
IUPAC Name:
1-cyclopropylsulfonyl-1,4-diazepane
InChI:
InChI=1S/C8H16N2O2S/c11-13(12,8-2-3-8)10-6-1-4-9-5-7-10/h8-9H,1-7H2
InChI Key:
RTVOCMJYAAFMOI-UHFFFAOYSA-N
SMILES:
O=S(=O)(C1CC1)N1CCNCCC1

Properties

Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.093g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
204.288g/mol
Monoisotopic Mass:
204.093g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  

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