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Home Carbonyls 1-(thiophene-2-carbonyl)-1,4-diazepane hydrochloride

1-(thiophene-2-carbonyl)-1,4-diazepane hydrochloride

CAS No.:
1311315-12-4
Catalog Number:
AG01AHOY
Molecular Formula:
C10H15ClN2OS
Molecular Weight:
246.7569
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Product Description
Catalog Number:
AG01AHOY
Chemical Name:
1-(thiophene-2-carbonyl)-1,4-diazepane hydrochloride
CAS Number:
1311315-12-4
Molecular Formula:
C10H15ClN2OS
Molecular Weight:
246.7569
MDL Number:
MFCD18785553
IUPAC Name:
1,4-diazepan-1-yl(thiophen-2-yl)methanone;hydrochloride
InChI:
InChI=1S/C10H14N2OS.ClH/c13-10(9-3-1-8-14-9)12-6-2-4-11-5-7-12;/h1,3,8,11H,2,4-7H2;1H
InChI Key:
HSCJSTISJXGVHR-UHFFFAOYSA-N
SMILES:
O=C(c1cccs1)N1CCNCCC1.Cl
Properties
Complexity:
210  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.059g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
246.753g/mol
Monoisotopic Mass:
246.059g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
60.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties