CID 57433789

C9H19 — CID 57433789

IUPAC—
SMILESCC(C)[CH]CCC(C)C
InChIInChI=1S/C9H19/c1-8(2)6-5-7-9(3)4/h6,8-9H,5,7H2,1-4H3
InChIKeyWPSVHVLIHCVMSF-UHFFFAOYSA-N
MW127.25 g/mol
LogP3.28
Rot. Bonds4

About CID 57433789

CID 57433789 (PubChem CID 57433789) has the molecular formula C9H19 and a molecular weight of 127.25 g/mol.

Molecular Properties

Compound NameCID 57433789
PubChem CID57433789
Molecular FormulaC9H19
Molecular Weight127.25 g/mol
Exact Mass127.15
IUPAC Name—
SMILESCC(C)[CH]CCC(C)C
InChIInChI=1S/C9H19/c1-8(2)6-5-7-9(3)4/h6,8-9H,5,7H2,1-4H3
InChIKeyWPSVHVLIHCVMSF-UHFFFAOYSA-N
XLogP3.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.25
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

bis(buta-1,3-diene);5-methylhex-1-ene
CID 174724270
methane;4-methylpentanal
CID 87157049
2,5-dimethylhexane;(E)-2,5-dimethylhex-3-ene
CID 160891186
5-methylhex-1-en-1-amine
CID 87108942
2,8-dimethylnon-4-ene
CID 54058844
(E)-2,11-dimethyldodec-5-ene
CID 168834978
(Z)-but-2-ene;2,5-dimethylhexane
CID 144935211
2,9-dimethylundec-5-ene
CID 123952487
(E)-2,13-dimethyltetradec-7-ene
CID 176630990
trimethyl(7-methyloct-3-enyl)azanium
CID 123575758
(E)-2,12-dimethyltridec-6-ene
CID 176630963
(Z)-2,15-dimethylhexadec-8-ene
CID 176630952

Frequently Asked Questions

What is the IUPAC name of CID 57433789?
The IUPAC name of CID 57433789 (CID 57433789) is not available.
What is the SMILES notation for CID 57433789?
The canonical SMILES for CID 57433789 is CC(C)[CH]CCC(C)C.
What is the InChIKey of CID 57433789?
The InChIKey is WPSVHVLIHCVMSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19/c1-8(2)6-5-7-9(3)4/h6,8-9H,5,7H2,1-4H3.
What are the key properties of CID 57433789?
CID 57433789 has a molecular weight of 127.25 g/mol, XLogP of 3.28, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 57433789 is sourced from PubChem (CID 57433789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).