methane;prop-1-ene;3,3,5,5-tetramethylhex-1-ene

C14H30 — CID 142214554

IUPACmethane;prop-1-ene;3,3,5,5-tetramethylhex-1-ene
SMILESC.C=CC.C=CC(C)(C)CC(C)(C)C
InChIInChI=1S/C10H20.C3H6.CH4/c1-7-10(5,6)8-9(2,3)4;1-3-2;/h7H,1,8H2,2-6H3;3H,1H2,2H3;1H4
InChIKeyFAHWHAGJFSKQTA-UHFFFAOYSA-N
MW198.39 g/mol
LogP5.46
Rot. Bonds2

About methane;prop-1-ene;3,3,5,5-tetramethylhex-1-ene

methane;prop-1-ene;3,3,5,5-tetramethylhex-1-ene (PubChem CID 142214554) has the molecular formula C14H30 and a molecular weight of 198.39 g/mol. Its IUPAC name is methane;prop-1-ene;3,3,5,5-tetramethylhex-1-ene.

Molecular Properties

Compound Namemethane;prop-1-ene;3,3,5,5-tetramethylhex-1-ene
PubChem CID142214554
Molecular FormulaC14H30
Molecular Weight198.39 g/mol
Exact Mass198.23
IUPAC Namemethane;prop-1-ene;3,3,5,5-tetramethylhex-1-ene
SMILESC.C=CC.C=CC(C)(C)CC(C)(C)C
InChIInChI=1S/C10H20.C3H6.CH4/c1-7-10(5,6)8-9(2,3)4;1-3-2;/h7H,1,8H2,2-6H3;3H,1H2,2H3;1H4
InChIKeyFAHWHAGJFSKQTA-UHFFFAOYSA-N
XLogP5.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500198.39
LogP ≤ 55.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2,2,4,4,7,7,9,9-octamethyldec-5-ene
CID 90796396
(E)-4,4,6,6-tetramethylhept-2-ene
CID 20870209
ethene;tetrakis(prop-1-ene)
CID 158667737
3,3,5,5-tetramethylnona-1,8-diene
CID 91102311
3,3-dimethylpent-1-ene;ethane
CID 142059460
2,2,4,4,7,7,9,9-octamethyldec-5-enal
CID 123537893
3,5,5-trimethyl-3-propan-2-ylhex-1-ene
CID 123318417
2,2,4,4-tetramethylhex-5-eneperoxoic acid
CID 88598611
ethene;prop-1-ene;decahydrofluoride
CID 172847314
ethane;methane;bis(prop-1-ene)
CID 159459488
methane;prop-1-ene;sulfane
CID 20979358
prop-1-ene
CID 162178440

Frequently Asked Questions

What is the IUPAC name of methane;prop-1-ene;3,3,5,5-tetramethylhex-1-ene?
The IUPAC name of methane;prop-1-ene;3,3,5,5-tetramethylhex-1-ene (CID 142214554) is methane;prop-1-ene;3,3,5,5-tetramethylhex-1-ene.
What is the SMILES notation for methane;prop-1-ene;3,3,5,5-tetramethylhex-1-ene?
The canonical SMILES for methane;prop-1-ene;3,3,5,5-tetramethylhex-1-ene is C.C=CC.C=CC(C)(C)CC(C)(C)C.
What is the InChIKey of methane;prop-1-ene;3,3,5,5-tetramethylhex-1-ene?
The InChIKey is FAHWHAGJFSKQTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20.C3H6.CH4/c1-7-10(5,6)8-9(2,3)4;1-3-2;/h7H,1,8H2,2-6H3;3H,1H2,2H3;1H4.
What are the key properties of methane;prop-1-ene;3,3,5,5-tetramethylhex-1-ene?
methane;prop-1-ene;3,3,5,5-tetramethylhex-1-ene has a molecular weight of 198.39 g/mol, XLogP of 5.46, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methane;prop-1-ene;3,3,5,5-tetramethylhex-1-ene is sourced from PubChem (CID 142214554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).