5943
1
2
3
4
5
17
17
17
17
6
1
2
3
4
5
5
5
5
1
1
1
1
1
5
255
1
2
3
4
5
3.732
2
2.366
3.366
2.866
0.5
-0.5
0.866
-0.866
0
0
Compound
Canonicalized
5
2011.04.04
1
Compound Complexity
7
E_COMPLEXITY
3.384
Cactvs
xemistry.com
2011.09.13
19.1
Count
Hydrogen Bond Acceptor
5
E_NHACCEPTORS
3.384
Cactvs
xemistry.com
2011.09.13
0
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
00000371000000000700000000000000000000000000000000000000000000000000000000000000020000000000000000800000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000
IUPAC Name
Allowed
1
2.0.2
LexiChem
openeye.com
2011.09.13
carbon tetrachloride
IUPAC Name
CAS-like Style
1
2.0.2
LexiChem
openeye.com
2011.09.13
tetrachloromethane
IUPAC Name
Preferred
1
2.0.2
LexiChem
openeye.com
2011.09.13
tetrachloromethane
IUPAC Name
Systematic
1
2.0.2
LexiChem
openeye.com
2011.09.13
tetrakis(chloranyl)methane
IUPAC Name
Traditional
1
2.0.2
LexiChem
openeye.com
2011.09.13
carbon tetrachloride
InChI
Standard
1
1.0.3
InChI
nist.gov
2011.09.13
InChI=1S/CCl4/c2-1(3,4)5
InChIKey
Standard
1
1.0.3
InChI
nist.gov
2011.09.13
VZGDMQKNWNREIO-UHFFFAOYSA-N
Log P
XLogP3-AA
7
3.0
sioc-ccbg.ac.cn
2011.09.13
2.8
Mass
Exact
7
2.1
PubChem
ncbi.nlm.nih.gov
2011.09.13
153.872461
Molecular Formula
1
2.1
PubChem
ncbi.nlm.nih.gov
2011.09.13
CCl4
Molecular Weight
7
2.1
PubChem
ncbi.nlm.nih.gov
2011.09.13
153.8227
SMILES
Canonical
1
1.7.4
OEChem
openeye.com
2011.09.13
C(Cl)(Cl)(Cl)Cl
SMILES
Isomeric
1
1.7.4
OEChem
openeye.com
2011.09.13
C(Cl)(Cl)(Cl)Cl
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
151.875411
5
0
0
0
0
0
0
0
1
1