Home Aminos 3-(aminomethyl)-1lambda6-benzothiophene-1,1-dione hydrochloride

3-(aminomethyl)-1lambda6-benzothiophene-1,1-dione hydrochloride

CAS No.:
1797215-10-1
Catalog Number:
AG01B1OJ
Molecular Formula:
C9H10ClNO2S
Molecular Weight:
231.6992
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Product Description
Catalog Number:
AG01B1OJ
Chemical Name:
3-(aminomethyl)-1lambda6-benzothiophene-1,1-dione hydrochloride
CAS Number:
1797215-10-1
Molecular Formula:
C9H10ClNO2S
Molecular Weight:
231.6992
MDL Number:
MFCD27980950
IUPAC Name:
(1,1-dioxo-1-benzothiophen-3-yl)methanamine;hydrochloride
InChI:
InChI=1S/C9H9NO2S.ClH/c10-5-7-6-13(11,12)9-4-2-1-3-8(7)9;/h1-4,6H,5,10H2;1H
InChI Key:
IODHAJHGQHJGAD-UHFFFAOYSA-N
SMILES:
NCC1=CS(=O)(=O)c2c1cccc2.Cl
Properties
Complexity:
326  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.012g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
231.694g/mol
Monoisotopic Mass:
231.012g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties