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1228878-45-2 | Cyclobutanemethanamine, 1-(4-bromophenyl)-, hydrochloride (1:1)
CAS No: 1228878-45-2 Catalog No: AG000JO4 MDL No:MFCD09864761
Product Description
Catalog Number:
AG000JO4
Chemical Name:
Cyclobutanemethanamine, 1-(4-bromophenyl)-, hydrochloride (1:1)
CAS Number:
1228878-45-2
Molecular Formula:
C11H15BrClN
Molecular Weight:
276.6005
MDL Number:
MFCD09864761
IUPAC Name:
[1-(4-bromophenyl)cyclobutyl]methanamine;hydrochloride
InChI:
InChI=1S/C11H14BrN.ClH/c12-10-4-2-9(3-5-10)11(8-13)6-1-7-11;/h2-5H,1,6-8,13H2;1H
InChI Key:
PGVMTOUDCXVEJJ-UHFFFAOYSA-N
SMILES:
NCC1(CCC1)c1ccc(cc1)Br.Cl
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.008g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
276.602g/mol
Monoisotopic Mass:
275.008g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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