CID 174606444

CH10AlBN — CID 174606444

IUPAC—
SMILESC.N.[AlH3].[B]
InChIInChI=1S/CH4.Al.B.H3N.3H/h1H4;;;1H3;;;
InChIKeyHAYBYUBLXPNNLD-UHFFFAOYSA-N
MW73.89 g/mol
LogP-0.77
Rot. Bonds

About CID 174606444

CID 174606444 (PubChem CID 174606444) has the molecular formula CH10AlBN and a molecular weight of 73.89 g/mol.

Molecular Properties

Compound NameCID 174606444
PubChem CID174606444
Molecular FormulaCH10AlBN
Molecular Weight73.89 g/mol
Exact Mass74.07
IUPAC Name—
SMILESC.N.[AlH3].[B]
InChIInChI=1S/CH4.Al.B.H3N.3H/h1H4;;;1H3;;;
InChIKeyHAYBYUBLXPNNLD-UHFFFAOYSA-N
XLogP-0.77
TPSA35.00 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50073.89
LogP ≤ 5-0.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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azane;methane;hydrochloride
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Frequently Asked Questions

What is the IUPAC name of CID 174606444?
The IUPAC name of CID 174606444 (CID 174606444) is not available.
What is the SMILES notation for CID 174606444?
The canonical SMILES for CID 174606444 is C.N.[AlH3].[B].
What is the InChIKey of CID 174606444?
The InChIKey is HAYBYUBLXPNNLD-UHFFFAOYSA-N. The full InChI is InChI=1S/CH4.Al.B.H3N.3H/h1H4;;;1H3;;;.
What are the key properties of CID 174606444?
CID 174606444 has a molecular weight of 73.89 g/mol, XLogP of -0.77, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 174606444 is sourced from PubChem (CID 174606444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).