actinium;(5-methyltetrazol-2-yl)methanol

C3H6AcN4O — CID 59058893

IUPACactinium;(5-methyltetrazol-2-yl)methanol
SMILESCc1nnn(CO)n1.[Ac]
InChIInChI=1S/C3H6N4O.Ac/c1-3-4-6-7(2-8)5-3;/h8H,2H2,1H3;
InChIKeyLDMZSYOTZXNDGJ-UHFFFAOYSA-N
MW341.11 g/mol
LogP-1.07
Rot. Bonds1

About actinium;(5-methyltetrazol-2-yl)methanol

actinium;(5-methyltetrazol-2-yl)methanol (PubChem CID 59058893) has the molecular formula C3H6AcN4O and a molecular weight of 341.11 g/mol. Its IUPAC name is actinium;(5-methyltetrazol-2-yl)methanol.

Molecular Properties

Compound Nameactinium;(5-methyltetrazol-2-yl)methanol
PubChem CID59058893
Molecular FormulaC3H6AcN4O
Molecular Weight341.11 g/mol
Exact Mass341.08
IUPAC Nameactinium;(5-methyltetrazol-2-yl)methanol
SMILESCc1nnn(CO)n1.[Ac]
InChIInChI=1S/C3H6N4O.Ac/c1-3-4-6-7(2-8)5-3;/h8H,2H2,1H3;
InChIKeyLDMZSYOTZXNDGJ-UHFFFAOYSA-N
XLogP-1.07
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.11
LogP ≤ 5-1.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of actinium;(5-methyltetrazol-2-yl)methanol?
The IUPAC name of actinium;(5-methyltetrazol-2-yl)methanol (CID 59058893) is actinium;(5-methyltetrazol-2-yl)methanol.
What is the SMILES notation for actinium;(5-methyltetrazol-2-yl)methanol?
The canonical SMILES for actinium;(5-methyltetrazol-2-yl)methanol is Cc1nnn(CO)n1.[Ac].
What is the InChIKey of actinium;(5-methyltetrazol-2-yl)methanol?
The InChIKey is LDMZSYOTZXNDGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6N4O.Ac/c1-3-4-6-7(2-8)5-3;/h8H,2H2,1H3;.
What are the key properties of actinium;(5-methyltetrazol-2-yl)methanol?
actinium;(5-methyltetrazol-2-yl)methanol has a molecular weight of 341.11 g/mol, XLogP of -1.07, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for actinium;(5-methyltetrazol-2-yl)methanol is sourced from PubChem (CID 59058893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).