6356
1
2
3
4
9
9
9
5
1
2
3
4
4
4
1
1
1
1
5
255
1
2
3
4
3.732
2
2.866
2.866
0.75
0.75
-0.75
0.25
0
Compound
Canonicalized
5
2011.04.04
1
Compound Complexity
7
E_COMPLEXITY
3.384
Cactvs
xemistry.com
2011.09.13
8
Count
Hydrogen Bond Acceptor
5
E_NHACCEPTORS
3.384
Cactvs
xemistry.com
2011.09.13
3
Count
Hydrogen Bond Donor
5
E_NHDONORS
3.384
Cactvs
xemistry.com
2011.09.13
0
Count
Rotatable Bond
5
E_NROTBONDS
3.384
Cactvs
xemistry.com
2011.09.13
0
Fingerprint
SubStructure Keys
16
extended 2
E_SCREEN
3.384
Cactvs
xemistry.com
2011.09.13
00000371020001800000000000000000000000000000000000000000000000000000000000000400000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000
IUPAC Name
Allowed
1
2.0.2
LexiChem
openeye.com
2011.09.13
trifluoroborane
IUPAC Name
CAS-like Style
1
2.0.2
LexiChem
openeye.com
2011.09.13
trifluoroborane
IUPAC Name
Preferred
1
2.0.2
LexiChem
openeye.com
2011.09.13
trifluoroborane
IUPAC Name
Systematic
1
2.0.2
LexiChem
openeye.com
2011.09.13
tris(fluoranyl)borane
IUPAC Name
Traditional
1
2.0.2
LexiChem
openeye.com
2011.09.13
trifluoroborane
InChI
Standard
1
1.0.3
InChI
nist.gov
2011.09.13
InChI=1S/BF3/c2-1(3)4
InChIKey
Standard
1
1.0.3
InChI
nist.gov
2011.09.13
WTEOIRVLGSZEPR-UHFFFAOYSA-N
Mass
Exact
7
2.1
PubChem
ncbi.nlm.nih.gov
2011.09.13
68.004515
Molecular Formula
1
2.1
PubChem
ncbi.nlm.nih.gov
2011.09.13
BF3
Molecular Weight
7
2.1
PubChem
ncbi.nlm.nih.gov
2011.09.13
67.80621
SMILES
Canonical
1
1.7.4
OEChem
openeye.com
2011.09.13
B(F)(F)F
SMILES
Isomeric
1
1.7.4
OEChem
openeye.com
2011.09.13
B(F)(F)F
Topological
Polar Surface Area
7
E_TPSA
3.384
Cactvs
xemistry.com
2011.09.13
0
Weight
MonoIsotopic
7
2.1
PubChem
ncbi.nlm.nih.gov
2011.09.13
68.004515
4
0
0
0
0
0
0
0
1
1