di(propan-2-yl)alumanylformonitrile

C7H14AlN — CID 88500264

IUPACdi(propan-2-yl)alumanylformonitrile
SMILESCC(C)[Al](C#N)C(C)C
InChIInChI=1S/2C3H7.CN.Al/c2*1-3-2;1-2;/h2*3H,1-2H3;;
InChIKeyWNOKNTBRWLYECA-UHFFFAOYSA-N
MW139.18 g/mol
LogP2.36
Rot. Bonds2

About di(propan-2-yl)alumanylformonitrile

di(propan-2-yl)alumanylformonitrile (PubChem CID 88500264) has the molecular formula C7H14AlN and a molecular weight of 139.18 g/mol. Its IUPAC name is di(propan-2-yl)alumanylformonitrile.

Molecular Properties

Compound Namedi(propan-2-yl)alumanylformonitrile
PubChem CID88500264
Molecular FormulaC7H14AlN
Molecular Weight139.18 g/mol
Exact Mass139.09
IUPAC Namedi(propan-2-yl)alumanylformonitrile
SMILESCC(C)[Al](C#N)C(C)C
InChIInChI=1S/2C3H7.CN.Al/c2*1-3-2;1-2;/h2*3H,1-2H3;;
InChIKeyWNOKNTBRWLYECA-UHFFFAOYSA-N
XLogP2.36
TPSA23.79 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.18
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of di(propan-2-yl)alumanylformonitrile?
The IUPAC name of di(propan-2-yl)alumanylformonitrile (CID 88500264) is di(propan-2-yl)alumanylformonitrile.
What is the SMILES notation for di(propan-2-yl)alumanylformonitrile?
The canonical SMILES for di(propan-2-yl)alumanylformonitrile is CC(C)[Al](C#N)C(C)C.
What is the InChIKey of di(propan-2-yl)alumanylformonitrile?
The InChIKey is WNOKNTBRWLYECA-UHFFFAOYSA-N. The full InChI is InChI=1S/2C3H7.CN.Al/c2*1-3-2;1-2;/h2*3H,1-2H3;;.
What are the key properties of di(propan-2-yl)alumanylformonitrile?
di(propan-2-yl)alumanylformonitrile has a molecular weight of 139.18 g/mol, XLogP of 2.36, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for di(propan-2-yl)alumanylformonitrile is sourced from PubChem (CID 88500264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).