Home Halogens 8-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-amine hydrochloride

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

CAS No.:
37483-69-5
Catalog Number:
AG01A4P4
Molecular Formula:
C10H13Cl2NO
Molecular Weight:
234.1223
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Product Description
Catalog Number:
AG01A4P4
Chemical Name:
8-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-amine hydrochloride
CAS Number:
37483-69-5
Molecular Formula:
C10H13Cl2NO
Molecular Weight:
234.1223
MDL Number:
MFCD01664370
IUPAC Name:
8-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-amine;hydrochloride
InChI:
InChI=1S/C10H12ClNO.ClH/c11-7-3-4-8-9(12)2-1-5-13-10(8)6-7;/h3-4,6,9H,1-2,5,12H2;1H
InChI Key:
ZRAQEMHFRRTQPF-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)OCCCC2N.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