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Home > Bromides > 1824469-41-1
1824469-41-1 | 3-bromocyclobutane-1-carbonitrile
CAS No: 1824469-41-1 Catalog No: AG01ELRH MDL No:MFCD24510190
Product Description
Catalog Number:
AG01ELRH
Chemical Name:
3-bromocyclobutane-1-carbonitrile
CAS Number:
1824469-41-1
Molecular Formula:
C5H6BrN
Molecular Weight:
160.0118
MDL Number:
MFCD24510190
IUPAC Name:
3-bromocyclobutane-1-carbonitrile
InChI:
InChI=1S/C5H6BrN/c6-5-1-4(2-5)3-7/h4-5H,1-2H2
InChI Key:
LBRODAGZBGRWHA-UHFFFAOYSA-N
SMILES:
BrC1CC(C1)C#N
Properties
Complexity:
107
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.968g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.014g/mol
Monoisotopic Mass:
158.968g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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