methyl [(Z)-3-(trimethylsilylmethyl)hex-3-en-2-yl] carbonate

C12H24O3Si — CID 10467007

IUPACmethyl [(Z)-3-(trimethylsilylmethyl)hex-3-en-2-yl] carbonate
SMILESCC/C=C(\C[Si](C)(C)C)C(C)OC(=O)OC
InChIInChI=1S/C12H24O3Si/c1-7-8-11(9-16(4,5)6)10(2)15-12(13)14-3/h8,10H,7,9H2,1-6H3/b11-8+
InChIKeyHORWGDPHPHVUGF-DHZHZOJOSA-N
MW244.41 g/mol
LogP3.83
Rot. Bonds5

About methyl [(Z)-3-(trimethylsilylmethyl)hex-3-en-2-yl] carbonate

methyl [(Z)-3-(trimethylsilylmethyl)hex-3-en-2-yl] carbonate (PubChem CID 10467007) has the molecular formula C12H24O3Si and a molecular weight of 244.41 g/mol. Its IUPAC name is methyl [(Z)-3-(trimethylsilylmethyl)hex-3-en-2-yl] carbonate.

Molecular Properties

Compound Namemethyl [(Z)-3-(trimethylsilylmethyl)hex-3-en-2-yl] carbonate
PubChem CID10467007
Molecular FormulaC12H24O3Si
Molecular Weight244.41 g/mol
Exact Mass244.15
IUPAC Namemethyl [(Z)-3-(trimethylsilylmethyl)hex-3-en-2-yl] carbonate
SMILESCC/C=C(\C[Si](C)(C)C)C(C)OC(=O)OC
InChIInChI=1S/C12H24O3Si/c1-7-8-11(9-16(4,5)6)10(2)15-12(13)14-3/h8,10H,7,9H2,1-6H3/b11-8+
InChIKeyHORWGDPHPHVUGF-DHZHZOJOSA-N
XLogP3.83
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.41
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[(E,4S)-4-[tert-butyl(dimethyl)silyl]oxypent-2-enyl] methyl carbonate
CID 15326321
[(E)-5-[tert-butyl(dimethyl)silyl]oxypent-2-enyl] methyl carbonate
CID 46702477
tert-butyl-[(E,2S)-4-(methoxymethoxymethyl)hex-3-en-2-yl]oxy-dimethylsilane
CID 135019503
methyl [(Z)-4-methyl-6-trimethylsilylhex-3-en-5-yn-2-yl] carbonate
CID 53466998
Bis(2-methylpent-2-enyl) carbonate
CID 57061938
[(3E)-4,8-dimethylnona-3,7-dien-2-yl] ethyl carbonate
CID 57483483
4,8-Dimethylnona-3,7-dien-2-yl ethyl carbonate
CID 91096745
methyl [(E)-3-(trimethylsilylmethyl)hex-3-en-2-yl] carbonate
CID 10263884
[(Z,4S)-4-[tert-butyl(dimethyl)silyl]oxypent-2-enyl] methyl carbonate
CID 10754827
Methyl [2-(trimethylsilylmethyl)cyclopent-2-en-1-yl] carbonate
CID 10799384
methyl [(E,2R)-4-trimethylsilylbut-3-en-2-yl] carbonate
CID 11095691
[(E,4R,5R)-5-[tert-butyl(dimethyl)silyl]oxy-4-methylhex-2-enyl] methyl carbonate
CID 11120200

Frequently Asked Questions

What is the IUPAC name of methyl [(Z)-3-(trimethylsilylmethyl)hex-3-en-2-yl] carbonate?
The IUPAC name of methyl [(Z)-3-(trimethylsilylmethyl)hex-3-en-2-yl] carbonate (CID 10467007) is methyl [(Z)-3-(trimethylsilylmethyl)hex-3-en-2-yl] carbonate.
What is the SMILES notation for methyl [(Z)-3-(trimethylsilylmethyl)hex-3-en-2-yl] carbonate?
The canonical SMILES for methyl [(Z)-3-(trimethylsilylmethyl)hex-3-en-2-yl] carbonate is CC/C=C(\C[Si](C)(C)C)C(C)OC(=O)OC.
What is the InChIKey of methyl [(Z)-3-(trimethylsilylmethyl)hex-3-en-2-yl] carbonate?
The InChIKey is HORWGDPHPHVUGF-DHZHZOJOSA-N. The full InChI is InChI=1S/C12H24O3Si/c1-7-8-11(9-16(4,5)6)10(2)15-12(13)14-3/h8,10H,7,9H2,1-6H3/b11-8+.
What are the key properties of methyl [(Z)-3-(trimethylsilylmethyl)hex-3-en-2-yl] carbonate?
methyl [(Z)-3-(trimethylsilylmethyl)hex-3-en-2-yl] carbonate has a molecular weight of 244.41 g/mol, XLogP of 3.83, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl [(Z)-3-(trimethylsilylmethyl)hex-3-en-2-yl] carbonate is sourced from PubChem (CID 10467007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).