chloro(dimethyl)alumane;dichloromethane

C3H8AlCl3 — CID 161137933

IUPACchloro(dimethyl)alumane;dichloromethane
SMILESC[Al](C)Cl.ClCCl
InChIInChI=1S/CH2Cl2.2CH3.Al.ClH/c2-1-3;;;;/h1H2;2*1H3;;1H/q;;;+1;/p-1
InChIKeyNXRPZQSTQKJMGY-UHFFFAOYSA-M
MW177.44 g/mol
LogP2.90
Rot. Bonds

About chloro(dimethyl)alumane;dichloromethane

chloro(dimethyl)alumane;dichloromethane (PubChem CID 161137933) has the molecular formula C3H8AlCl3 and a molecular weight of 177.44 g/mol. Its IUPAC name is chloro(dimethyl)alumane;dichloromethane.

Molecular Properties

Compound Namechloro(dimethyl)alumane;dichloromethane
PubChem CID161137933
Molecular FormulaC3H8AlCl3
Molecular Weight177.44 g/mol
Exact Mass175.95
IUPAC Namechloro(dimethyl)alumane;dichloromethane
SMILESC[Al](C)Cl.ClCCl
InChIInChI=1S/CH2Cl2.2CH3.Al.ClH/c2-1-3;;;;/h1H2;2*1H3;;1H/q;;;+1;/p-1
InChIKeyNXRPZQSTQKJMGY-UHFFFAOYSA-M
XLogP2.90
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.44
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

chloromethyl(dimethyl)alumane
CID 170946047
chloro(dimethyl)alumane;hexadecane
CID 174630771
(dichloromethane);methanol
CID 173151406
(dichloromethane);methanol
CID 173026294
(dichloromethane);methanol
CID 173499764
dichloro(methyl)alumane;dihydrochloride
CID 172795512
(dichloromethane);pentacontahydrate
CID 173399237
dichloromethane;germane
CID 174557663
CID 87274674
CID 87274674
dichloromethane;proton
CID 174889445
azane;bis(dichloromethane);methanol
CID 173301949
dichloromethane;methane;methanol
CID 161268863

Frequently Asked Questions

What is the IUPAC name of chloro(dimethyl)alumane;dichloromethane?
The IUPAC name of chloro(dimethyl)alumane;dichloromethane (CID 161137933) is chloro(dimethyl)alumane;dichloromethane.
What is the SMILES notation for chloro(dimethyl)alumane;dichloromethane?
The canonical SMILES for chloro(dimethyl)alumane;dichloromethane is C[Al](C)Cl.ClCCl.
What is the InChIKey of chloro(dimethyl)alumane;dichloromethane?
The InChIKey is NXRPZQSTQKJMGY-UHFFFAOYSA-M. The full InChI is InChI=1S/CH2Cl2.2CH3.Al.ClH/c2-1-3;;;;/h1H2;2*1H3;;1H/q;;;+1;/p-1.
What are the key properties of chloro(dimethyl)alumane;dichloromethane?
chloro(dimethyl)alumane;dichloromethane has a molecular weight of 177.44 g/mol, XLogP of 2.90, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro(dimethyl)alumane;dichloromethane is sourced from PubChem (CID 161137933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).