CID 100913906

C10H19O — CID 100913906

IUPAC—
SMILESCC(C)(C[O])C1CCCCC1
InChIInChI=1S/C10H19O/c1-10(2,8-11)9-6-4-3-5-7-9/h9H,3-8H2,1-2H3
InChIKeyZHKAHCGTDXZFLH-UHFFFAOYSA-N
MW155.26 g/mol
LogP3.02
Rot. Bonds2

About CID 100913906

CID 100913906 (PubChem CID 100913906) has the molecular formula C10H19O and a molecular weight of 155.26 g/mol.

Molecular Properties

Compound NameCID 100913906
PubChem CID100913906
Molecular FormulaC10H19O
Molecular Weight155.26 g/mol
Exact Mass155.14
IUPAC Name—
SMILESCC(C)(C[O])C1CCCCC1
InChIInChI=1S/C10H19O/c1-10(2,8-11)9-6-4-3-5-7-9/h9H,3-8H2,1-2H3
InChIKeyZHKAHCGTDXZFLH-UHFFFAOYSA-N
XLogP3.02
TPSA19.90 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.26
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of CID 100913906?
The IUPAC name of CID 100913906 (CID 100913906) is not available.
What is the SMILES notation for CID 100913906?
The canonical SMILES for CID 100913906 is CC(C)(C[O])C1CCCCC1.
What is the InChIKey of CID 100913906?
The InChIKey is ZHKAHCGTDXZFLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19O/c1-10(2,8-11)9-6-4-3-5-7-9/h9H,3-8H2,1-2H3.
What are the key properties of CID 100913906?
CID 100913906 has a molecular weight of 155.26 g/mol, XLogP of 3.02, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 100913906 is sourced from PubChem (CID 100913906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).