Carbamic acid--silanol (1/1)

CH4NO3Si — CID 78063810

IUPAC—
SMILESNC(=O)O.O[Si]
InChIInChI=1S/CH3NO2.HOSi/c2-1(3)4;1-2/h2H2,(H,3,4);1H
InChIKeyLMJJYRHQMRSNAD-UHFFFAOYSA-N
MW106.13 g/mol
LogP-1.31
Rot. Bonds

About Carbamic acid--silanol (1/1)

Carbamic acid--silanol (1/1) (PubChem CID 78063810) has the molecular formula CH4NO3Si and a molecular weight of 106.13 g/mol.

Molecular Properties

Compound NameCarbamic acid--silanol (1/1)
PubChem CID78063810
Molecular FormulaCH4NO3Si
Molecular Weight106.13 g/mol
Exact Mass106.00
IUPAC Name—
SMILESNC(=O)O.O[Si]
InChIInChI=1S/CH3NO2.HOSi/c2-1(3)4;1-2/h2H2,(H,3,4);1H
InChIKeyLMJJYRHQMRSNAD-UHFFFAOYSA-N
XLogP-1.31
TPSA83.55 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500106.13
LogP ≤ 5-1.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of Carbamic acid--silanol (1/1)?
The IUPAC name of Carbamic acid--silanol (1/1) (CID 78063810) is not available.
What is the SMILES notation for Carbamic acid--silanol (1/1)?
The canonical SMILES for Carbamic acid--silanol (1/1) is NC(=O)O.O[Si].
What is the InChIKey of Carbamic acid--silanol (1/1)?
The InChIKey is LMJJYRHQMRSNAD-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3NO2.HOSi/c2-1(3)4;1-2/h2H2,(H,3,4);1H.
What are the key properties of Carbamic acid--silanol (1/1)?
Carbamic acid--silanol (1/1) has a molecular weight of 106.13 g/mol, XLogP of -1.31, 0 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for Carbamic acid--silanol (1/1) is sourced from PubChem (CID 78063810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).