Home Halogens 7-bromo-4,5-dihydro-3H-spiro[1,4-benzoxazepine-2,1'-cyclobutane] hydrochloride

7-bromo-4,5-dihydro-3H-spiro[1,4-benzoxazepine-2,1'-cyclobutane] hydrochloride

CAS No.:
2126177-19-1
Catalog Number:
AG01ELH3
Molecular Formula:
C12H15BrClNO
Molecular Weight:
304.6106
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Product Description
Catalog Number:
AG01ELH3
Chemical Name:
7-bromo-4,5-dihydro-3H-spiro[1,4-benzoxazepine-2,1'-cyclobutane] hydrochloride
CAS Number:
2126177-19-1
Molecular Formula:
C12H15BrClNO
Molecular Weight:
304.6106
MDL Number:
MFCD31381146
IUPAC Name:
7-bromospiro[4,5-dihydro-3H-1,4-benzoxazepine-2,1'-cyclobutane];hydrochloride
InChI:
InChI=1S/C12H14BrNO.ClH/c13-10-2-3-11-9(6-10)7-14-8-12(15-11)4-1-5-12;/h2-3,6,14H,1,4-5,7-8H2;1H
InChI Key:
OERRRJAIOBIHBW-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)CNCC1(O2)CCC1.Cl
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.003g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
304.612g/mol
Monoisotopic Mass:
303.003g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties