Home Sulfos 1-(cyclopropanesulfonyl)-1,4-diazepane hydrochloride

1-(cyclopropanesulfonyl)-1,4-diazepane hydrochloride

CAS No.:
1403952-62-4
Catalog Number:
AG01B97W
Molecular Formula:
C8H17ClN2O2S
Molecular Weight:
240.7508
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Product Description
Catalog Number:
AG01B97W
Chemical Name:
1-(cyclopropanesulfonyl)-1,4-diazepane hydrochloride
CAS Number:
1403952-62-4
Molecular Formula:
C8H17ClN2O2S
Molecular Weight:
240.7508
MDL Number:
MFCD28348282
IUPAC Name:
1-cyclopropylsulfonyl-1,4-diazepane;hydrochloride
InChI:
InChI=1S/C8H16N2O2S.ClH/c11-13(12,8-2-3-8)10-6-1-4-9-5-7-10;/h8-9H,1-7H2;1H
InChI Key:
XTMVRDYKNGVYJY-UHFFFAOYSA-N
SMILES:
O=S(=O)(C1CC1)N1CCNCCC1.Cl
Properties
Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.07g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
240.746g/mol
Monoisotopic Mass:
240.07g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties