2-(bromomethyl)prop-2-enoxy-tri(propan-2-yl)silane

C13H27BrOSi — CID 10924824

IUPAC2-(bromomethyl)prop-2-enoxy-tri(propan-2-yl)silane
SMILESC=C(CBr)CO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C13H27BrOSi/c1-10(2)16(11(3)4,12(5)6)15-9-13(7)8-14/h10-12H,7-9H2,1-6H3
InChIKeyDJTRCYISNGPZCF-UHFFFAOYSA-N
MW307.35 g/mol
LogP5.13
Rot. Bonds7

About 2-(bromomethyl)prop-2-enoxy-tri(propan-2-yl)silane

2-(bromomethyl)prop-2-enoxy-tri(propan-2-yl)silane (PubChem CID 10924824) has the molecular formula C13H27BrOSi and a molecular weight of 307.35 g/mol. Its IUPAC name is 2-(bromomethyl)prop-2-enoxy-tri(propan-2-yl)silane.

Molecular Properties

Compound Name2-(bromomethyl)prop-2-enoxy-tri(propan-2-yl)silane
PubChem CID10924824
Molecular FormulaC13H27BrOSi
Molecular Weight307.35 g/mol
Exact Mass306.10
IUPAC Name2-(bromomethyl)prop-2-enoxy-tri(propan-2-yl)silane
SMILESC=C(CBr)CO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C13H27BrOSi/c1-10(2)16(11(3)4,12(5)6)15-9-13(7)8-14/h10-12H,7-9H2,1-6H3
InChIKeyDJTRCYISNGPZCF-UHFFFAOYSA-N
XLogP5.13
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500307.35
LogP ≤ 55.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2-(bromomethyl)prop-2-enoxy-tri(propan-2-yl)silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

((2-(Bromomethyl)allyl)oxy)(tert-butyl)dimethylsilane
CID 10923433
Tert-butyl(dimethyl)((2-methylallyl)oxy)silane
CID 11159756
((2-Bromoallyl)oxy)(tert-butyl)dimethylsilane
CID 11265217
Triethyl(2-methylprop-2-enoxy)silane
CID 85927198
2-Methylprop-2-enoxy-tri(propan-2-yl)silane
CID 87879718
[(E)-4-bromo-2-methylbut-2-enoxy]-tert-butyl-dimethylsilane
CID 11161775
[(Z)-3-bromoprop-2-enoxy]-tert-butyl-dimethylsilane
CID 132477920
[(2R)-3-(bromomethyl)but-3-en-2-yl]oxy-tert-butyl-dimethylsilane
CID 15268628
4-Bromobuta-2,3-dienoxy-tert-butyl-dimethylsilane
CID 46196608
Bromozinc(1+);tert-butyl-dimethyl-(2-methylprop-2-enoxy)silane
CID 134887055
[(E)-3-bromo-2-(trifluoromethyl)prop-2-enoxy]-tert-butyl-dimethylsilane
CID 11638311
((4-Bromo-3-methylbut-2-en-1-yl)oxy)(tert-butyl)dimethylsilane
CID 11000419

Frequently Asked Questions

What is the IUPAC name of 2-(bromomethyl)prop-2-enoxy-tri(propan-2-yl)silane?
The IUPAC name of 2-(bromomethyl)prop-2-enoxy-tri(propan-2-yl)silane (CID 10924824) is 2-(bromomethyl)prop-2-enoxy-tri(propan-2-yl)silane.
What is the SMILES notation for 2-(bromomethyl)prop-2-enoxy-tri(propan-2-yl)silane?
The canonical SMILES for 2-(bromomethyl)prop-2-enoxy-tri(propan-2-yl)silane is C=C(CBr)CO[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of 2-(bromomethyl)prop-2-enoxy-tri(propan-2-yl)silane?
The InChIKey is DJTRCYISNGPZCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27BrOSi/c1-10(2)16(11(3)4,12(5)6)15-9-13(7)8-14/h10-12H,7-9H2,1-6H3.
What are the key properties of 2-(bromomethyl)prop-2-enoxy-tri(propan-2-yl)silane?
2-(bromomethyl)prop-2-enoxy-tri(propan-2-yl)silane has a molecular weight of 307.35 g/mol, XLogP of 5.13, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(bromomethyl)prop-2-enoxy-tri(propan-2-yl)silane is sourced from PubChem (CID 10924824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).