chloro-(chloromethyl)-bis(3-methylphenyl)silane

C15H16Cl2Si — CID 139686300

IUPACchloro-(chloromethyl)-bis(3-methylphenyl)silane
SMILESCc1cccc([Si](Cl)(CCl)c2cccc(C)c2)c1
InChIInChI=1S/C15H16Cl2Si/c1-12-5-3-7-14(9-12)18(17,11-16)15-8-4-6-13(2)10-15/h3-10H,11H2,1-2H3
InChIKeyPXXIWTAXSUQBJW-UHFFFAOYSA-N
MW295.29 g/mol
LogP3.38
Rot. Bonds3

About chloro-(chloromethyl)-bis(3-methylphenyl)silane

chloro-(chloromethyl)-bis(3-methylphenyl)silane (PubChem CID 139686300) has the molecular formula C15H16Cl2Si and a molecular weight of 295.29 g/mol. Its IUPAC name is chloro-(chloromethyl)-bis(3-methylphenyl)silane.

Molecular Properties

Compound Namechloro-(chloromethyl)-bis(3-methylphenyl)silane
PubChem CID139686300
Molecular FormulaC15H16Cl2Si
Molecular Weight295.29 g/mol
Exact Mass294.04
IUPAC Namechloro-(chloromethyl)-bis(3-methylphenyl)silane
SMILESCc1cccc([Si](Cl)(CCl)c2cccc(C)c2)c1
InChIInChI=1S/C15H16Cl2Si/c1-12-5-3-7-14(9-12)18(17,11-16)15-8-4-6-13(2)10-15/h3-10H,11H2,1-2H3
InChIKeyPXXIWTAXSUQBJW-UHFFFAOYSA-N
XLogP3.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.29
LogP ≤ 53.38
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'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Related Compounds

dichloro-ethyl-(3-methylphenyl)silane
CID 15514735
chloro-(3,5-dimethylphenyl)-bis(3-methylphenyl)silane
CID 88962318
ethyl-methyl-bis(3-methylphenyl)silane
CID 58460541
N-[chloro-bis(3-methylphenyl)silyl]-2-methylpropan-2-amine
CID 70011657
phosphane;tris(1,3-xylene)
CID 67351774
(3-methylphenyl)-tripropylsilane
CID 101204991
1,2-dichloro-4-methylbenzene;1,3-xylene
CID 158244707
dihydroxy-bis(3-methylphenyl)silane;dihydroxy(diphenyl)silane
CID 18695123
tris(3-methylphenyl)-triphenylsilyloxysilane
CID 5140856
argon;1,3-xylene
CID 161468194
uranium;1,3-xylene
CID 142096795
ethane;1,3-xylene
CID 54570178

Frequently Asked Questions

What is the IUPAC name of chloro-(chloromethyl)-bis(3-methylphenyl)silane?
The IUPAC name of chloro-(chloromethyl)-bis(3-methylphenyl)silane (CID 139686300) is chloro-(chloromethyl)-bis(3-methylphenyl)silane.
What is the SMILES notation for chloro-(chloromethyl)-bis(3-methylphenyl)silane?
The canonical SMILES for chloro-(chloromethyl)-bis(3-methylphenyl)silane is Cc1cccc([Si](Cl)(CCl)c2cccc(C)c2)c1.
What is the InChIKey of chloro-(chloromethyl)-bis(3-methylphenyl)silane?
The InChIKey is PXXIWTAXSUQBJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16Cl2Si/c1-12-5-3-7-14(9-12)18(17,11-16)15-8-4-6-13(2)10-15/h3-10H,11H2,1-2H3.
What are the key properties of chloro-(chloromethyl)-bis(3-methylphenyl)silane?
chloro-(chloromethyl)-bis(3-methylphenyl)silane has a molecular weight of 295.29 g/mol, XLogP of 3.38, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-(chloromethyl)-bis(3-methylphenyl)silane is sourced from PubChem (CID 139686300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).