CID 134889004

C10H16ClO2W — CID 134889004

IUPAC—
SMILESC[C]1C(C)=C(C)C(C)=C1C.Cl.O=[W]=O
InChIInChI=1S/C10H15.ClH.2O.W/c1-6-7(2)9(4)10(5)8(6)3;;;;/h1-5H3;1H;;;
InChIKeyLFHCAOKNDPHBHZ-UHFFFAOYSA-N
MW387.53 g/mol
LogP3.45
Rot. Bonds

About CID 134889004

CID 134889004 (PubChem CID 134889004) has the molecular formula C10H16ClO2W and a molecular weight of 387.53 g/mol.

Molecular Properties

Compound NameCID 134889004
PubChem CID134889004
Molecular FormulaC10H16ClO2W
Molecular Weight387.53 g/mol
Exact Mass387.03
IUPAC Name—
SMILESC[C]1C(C)=C(C)C(C)=C1C.Cl.O=[W]=O
InChIInChI=1S/C10H15.ClH.2O.W/c1-6-7(2)9(4)10(5)8(6)3;;;;/h1-5H3;1H;;;
InChIKeyLFHCAOKNDPHBHZ-UHFFFAOYSA-N
XLogP3.45
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.53
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 134889004?
The IUPAC name of CID 134889004 (CID 134889004) is not available.
What is the SMILES notation for CID 134889004?
The canonical SMILES for CID 134889004 is C[C]1C(C)=C(C)C(C)=C1C.Cl.O=[W]=O.
What is the InChIKey of CID 134889004?
The InChIKey is LFHCAOKNDPHBHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15.ClH.2O.W/c1-6-7(2)9(4)10(5)8(6)3;;;;/h1-5H3;1H;;;.
What are the key properties of CID 134889004?
CID 134889004 has a molecular weight of 387.53 g/mol, XLogP of 3.45, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134889004 is sourced from PubChem (CID 134889004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).