CID 136805435

C8H16ClO2Si — CID 136805435

IUPAC—
SMILESC[Si](C)O/C(=C\Cl)OC(C)(C)C
InChIInChI=1S/C8H16ClO2Si/c1-8(2,3)10-7(6-9)11-12(4)5/h6H,1-5H3/b7-6-
InChIKeyLKWCDHFCVDFFIC-SREVYHEPSA-N
MW207.75 g/mol
LogP3.11
Rot. Bonds3

About CID 136805435

CID 136805435 (PubChem CID 136805435) has the molecular formula C8H16ClO2Si and a molecular weight of 207.75 g/mol.

Molecular Properties

Compound NameCID 136805435
PubChem CID136805435
Molecular FormulaC8H16ClO2Si
Molecular Weight207.75 g/mol
Exact Mass207.06
IUPAC Name—
SMILESC[Si](C)O/C(=C\Cl)OC(C)(C)C
InChIInChI=1S/C8H16ClO2Si/c1-8(2,3)10-7(6-9)11-12(4)5/h6H,1-5H3/b7-6-
InChIKeyLKWCDHFCVDFFIC-SREVYHEPSA-N
XLogP3.11
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.75
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

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2-[(Z)-1,2-dichloro-2-[(2-methylpropan-2-yl)oxy]ethenoxy]-2-methylpropane
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trimethyl-[(Z)-1-[(2-methylpropan-2-yl)oxy]prop-1-enoxy]silane
CID 10878232
CID 11333193
CID 11333193
tert-butyl 2-tert-butyl-4-methylpent-3-enoate
CID 88849683
tert-butyl 2-bromobut-2-enoate
CID 86092926
tert-butyl (Z)-4-oxopent-2-enoate
CID 58880394
tert-butyl N-hydroxy-N-(1-oxopropan-2-yl)carbamate
CID 141352721
N,N-dimethyl-1-[(2-methylpropan-2-yl)oxy]ethenamine
CID 89011390
methane;4-[(2-methylpropan-2-yl)oxy]-4-oxobut-2-enoic acid
CID 173377461
4-[(2-methylpropan-2-yl)oxy]-4-oxobut-2-enoate
CID 7055993
tert-butyl (E)-3-[tert-butyl(dimethyl)silyl]oxyprop-2-enoate
CID 102348097

Frequently Asked Questions

What is the IUPAC name of CID 136805435?
The IUPAC name of CID 136805435 (CID 136805435) is not available.
What is the SMILES notation for CID 136805435?
The canonical SMILES for CID 136805435 is C[Si](C)O/C(=C\Cl)OC(C)(C)C.
What is the InChIKey of CID 136805435?
The InChIKey is LKWCDHFCVDFFIC-SREVYHEPSA-N. The full InChI is InChI=1S/C8H16ClO2Si/c1-8(2,3)10-7(6-9)11-12(4)5/h6H,1-5H3/b7-6-.
What are the key properties of CID 136805435?
CID 136805435 has a molecular weight of 207.75 g/mol, XLogP of 3.11, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 136805435 is sourced from PubChem (CID 136805435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).