Home Halogens 9-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-amine hydrochloride

9-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-amine hydrochloride

CAS No.:
1432678-03-9
Catalog Number:
AG01A4OD
Molecular Formula:
C10H13Cl2NO
Molecular Weight:
234.1223
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Product Description
Catalog Number:
AG01A4OD
Chemical Name:
9-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-amine hydrochloride
CAS Number:
1432678-03-9
Molecular Formula:
C10H13Cl2NO
Molecular Weight:
234.1223
MDL Number:
MFCD23701948
IUPAC Name:
9-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-amine;hydrochloride
InChI:
InChI=1S/C10H12ClNO.ClH/c11-8-4-1-3-7-9(12)5-2-6-13-10(7)8;/h1,3-4,9H,2,5-6,12H2;1H
InChI Key:
NOVYMKIZWZFVQQ-UHFFFAOYSA-N
SMILES:
NC1CCCOc2c1cccc2Cl.Cl
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.037g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
234.12g/mol
Monoisotopic Mass:
233.037g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties