CID 21546494
PubChem CID
21546494
Structure
Molecular Formula
Status
Non-live
Molecular Weight
193.03 g/mol
Dates
- Create:2007-12-05
Chemical Structure Depiction
InChI=1S/C10H13NO.BF/c1-2-4-10(5-3-1)11-6-8-12-9-7-11;1-2/h1-5H,6-9H2;
ZLCJXNWXLRZJIG-UHFFFAOYSA-N
[B]F.C1COCCN1C2=CC=CC=C2
C10H13BFNO
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
193.03 g/mol
Property Name
Hydrogen Bond Donor Count
Property Value
0
Property Name
Hydrogen Bond Acceptor Count
Property Value
3
Property Name
Rotatable Bond Count
Property Value
1
Property Name
Exact Mass
Property Value
193.1074224 g/mol
Property Name
Monoisotopic Mass
Property Value
193.1074224 g/mol
Property Name
Topological Polar Surface Area
Property Value
12.5 A^2
Property Name
Heavy Atom Count
Property Value
14
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
128
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
0
Property Name
Undefined Atom Stereocenter Count
Property Value
0
Property Name
Defined Bond Stereocenter Count
Property Value
0
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Property Name
Covalently-Bonded Unit Count
Property Value
2
Property Name
Compound Is Canonicalized
Property Value
Yes
Old substance
CONTENTS