[1-(chloromethyl)-3,4-dihydro-2H-naphthalen-1-yl]methyl-trimethylsilane

C15H23ClSi — CID 106324106

IUPAC[1-(chloromethyl)-3,4-dihydro-2H-naphthalen-1-yl]methyl-trimethylsilane
SMILESC[Si](C)(C)CC1(CCl)CCCc2ccccc21
InChIInChI=1S/C15H23ClSi/c1-17(2,3)12-15(11-16)10-6-8-13-7-4-5-9-14(13)15/h4-5,7,9H,6,8,10-12H2,1-3H3
InChIKeyYFMFRJDYLZEXKS-UHFFFAOYSA-N
MW266.89 g/mol
LogP4.84
Rot. Bonds3

About [1-(chloromethyl)-3,4-dihydro-2H-naphthalen-1-yl]methyl-trimethylsilane

[1-(chloromethyl)-3,4-dihydro-2H-naphthalen-1-yl]methyl-trimethylsilane (PubChem CID 106324106) has the molecular formula C15H23ClSi and a molecular weight of 266.89 g/mol. Its IUPAC name is [1-(chloromethyl)-3,4-dihydro-2H-naphthalen-1-yl]methyl-trimethylsilane.

Molecular Properties

Compound Name[1-(chloromethyl)-3,4-dihydro-2H-naphthalen-1-yl]methyl-trimethylsilane
PubChem CID106324106
Molecular FormulaC15H23ClSi
Molecular Weight266.89 g/mol
Exact Mass266.13
IUPAC Name[1-(chloromethyl)-3,4-dihydro-2H-naphthalen-1-yl]methyl-trimethylsilane
SMILESC[Si](C)(C)CC1(CCl)CCCc2ccccc21
InChIInChI=1S/C15H23ClSi/c1-17(2,3)12-15(11-16)10-6-8-13-7-4-5-9-14(13)15/h4-5,7,9H,6,8,10-12H2,1-3H3
InChIKeyYFMFRJDYLZEXKS-UHFFFAOYSA-N
XLogP4.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.89
LogP ≤ 54.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

N-[[1-(trimethylsilylmethyl)-3,4-dihydro-2H-naphthalen-1-yl]methyl]propan-2-amine
CID 106323563
4,4-diethyl-2,3-dihydro-1H-naphthalene
CID 520431
2-[2-[1-(chloromethyl)-3,4-dihydro-2H-naphthalen-1-yl]ethyl]thiophene
CID 66036104
4-(chloromethyl)-4-[(3,5-dimethylphenyl)methyl]-2,3-dihydro-1H-naphthalene
CID 66036331
4-(chloromethyl)-4-[(2-chlorophenyl)methyl]-2,3-dihydro-1H-naphthalene
CID 66036109
4-(chloromethyl)-4-(2-propylsulfonylethyl)-2,3-dihydro-1H-naphthalene
CID 106734497
4-(chloromethyl)-4-[2-(3-methoxypropoxy)ethyl]-2,3-dihydro-1H-naphthalene
CID 103184988
(1-ethyl-3,4-dihydro-2H-naphthalen-1-yl)methanol
CID 66059601
5-[[1-(chloromethyl)-3,4-dihydro-2H-naphthalen-1-yl]methyl]-1-propan-2-yl-1,2,4-triazole
CID 66033861
3-[2-[1-(chloromethyl)-3,4-dihydro-2H-naphthalen-1-yl]ethyl]thiophene
CID 66033638
1-[1-(methoxymethyl)-3,4-dihydro-2H-naphthalen-1-yl]-N-methylmethanamine
CID 103984610
4-(bromomethyl)-4-[(3,4-dichlorophenyl)methyl]-2,3-dihydro-1H-naphthalene
CID 66049410

Frequently Asked Questions

What is the IUPAC name of [1-(chloromethyl)-3,4-dihydro-2H-naphthalen-1-yl]methyl-trimethylsilane?
The IUPAC name of [1-(chloromethyl)-3,4-dihydro-2H-naphthalen-1-yl]methyl-trimethylsilane (CID 106324106) is [1-(chloromethyl)-3,4-dihydro-2H-naphthalen-1-yl]methyl-trimethylsilane.
What is the SMILES notation for [1-(chloromethyl)-3,4-dihydro-2H-naphthalen-1-yl]methyl-trimethylsilane?
The canonical SMILES for [1-(chloromethyl)-3,4-dihydro-2H-naphthalen-1-yl]methyl-trimethylsilane is C[Si](C)(C)CC1(CCl)CCCc2ccccc21.
What is the InChIKey of [1-(chloromethyl)-3,4-dihydro-2H-naphthalen-1-yl]methyl-trimethylsilane?
The InChIKey is YFMFRJDYLZEXKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23ClSi/c1-17(2,3)12-15(11-16)10-6-8-13-7-4-5-9-14(13)15/h4-5,7,9H,6,8,10-12H2,1-3H3.
What are the key properties of [1-(chloromethyl)-3,4-dihydro-2H-naphthalen-1-yl]methyl-trimethylsilane?
[1-(chloromethyl)-3,4-dihydro-2H-naphthalen-1-yl]methyl-trimethylsilane has a molecular weight of 266.89 g/mol, XLogP of 4.84, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(chloromethyl)-3,4-dihydro-2H-naphthalen-1-yl]methyl-trimethylsilane is sourced from PubChem (CID 106324106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).