6325
1
2
3
4
5
6
6
6
1
1
1
1
1
1
1
2
2
2
3
4
5
6
2
1
1
1
1
1
5
255
1
2
3
4
5
6
2
3
1.69
1.69
3.31
3.31
0
0
0.5369
-0.5369
-0.5369
0.5369
0
Compound
Canonicalized
5
2011.04.04
1
Compound Complexity
7
E_COMPLEXITY
3.384
Cactvs
xemistry.com
2011.09.13
0
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
00000371804000000000000000000000000000000000000000000000000000000000000000000018000000000000008000000000000000008000000200000000000000000800000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000
IUPAC Name
Allowed
1
2.0.2
LexiChem
openeye.com
2011.09.13
ethylene
IUPAC Name
CAS-like Style
1
2.0.2
LexiChem
openeye.com
2011.09.13
ethene
IUPAC Name
Preferred
1
2.0.2
LexiChem
openeye.com
2011.09.13
ethene
IUPAC Name
Systematic
1
2.0.2
LexiChem
openeye.com
2011.09.13
ethene
IUPAC Name
Traditional
1
2.0.2
LexiChem
openeye.com
2011.09.13
ethylene
InChI
Standard
1
1.0.3
InChI
nist.gov
2011.09.13
InChI=1S/C2H4/c1-2/h1-2H2
InChIKey
Standard
1
1.0.3
InChI
nist.gov
2011.09.13
VGGSQFUCUMXWEO-UHFFFAOYSA-N
Log P
XLogP3-AA
7
3.0
sioc-ccbg.ac.cn
2011.09.13
1.2
Mass
Exact
7
2.1
PubChem
ncbi.nlm.nih.gov
2011.09.13
28.0313
Molecular Formula
1
2.1
PubChem
ncbi.nlm.nih.gov
2011.09.13
C2H4
Molecular Weight
7
2.1
PubChem
ncbi.nlm.nih.gov
2011.09.13
28.05316
SMILES
Canonical
1
1.7.4
OEChem
openeye.com
2011.09.13
C=C
SMILES
Isomeric
1
1.7.4
OEChem
openeye.com
2011.09.13
C=C
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
28.0313
2
0
0
0
0
0
0
0
1
1