Home Halogens 7-bromo-2,3,4,5-tetrahydro-1,4-benzoxazepine hydrochloride

7-bromo-2,3,4,5-tetrahydro-1,4-benzoxazepine hydrochloride

CAS No.:
740842-72-2
Catalog Number:
AG01B973
Molecular Formula:
C9H11BrClNO
Molecular Weight:
264.5467
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Product Description
Catalog Number:
AG01B973
Chemical Name:
7-bromo-2,3,4,5-tetrahydro-1,4-benzoxazepine hydrochloride
CAS Number:
740842-72-2
Molecular Formula:
C9H11BrClNO
Molecular Weight:
264.5467
MDL Number:
MFCD26389238
IUPAC Name:
7-bromo-2,3,4,5-tetrahydro-1,4-benzoxazepine;hydrochloride
InChI:
InChI=1S/C9H10BrNO.ClH/c10-8-1-2-9-7(5-8)6-11-3-4-12-9;/h1-2,5,11H,3-4,6H2;1H
InChI Key:
ZYRMRIOGXGPYQY-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)CNCCO2.Cl
Properties
Complexity:
154  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.971g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
264.547g/mol
Monoisotopic Mass:
262.971g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties