azane;2-hydroxypropane-1,2,3-tricarboxylic acid;oxovanadium

C6H11NO8V — CID 174576062

IUPACazane;2-hydroxypropane-1,2,3-tricarboxylic acid;oxovanadium
SMILESN.O=C(O)CC(O)(CC(=O)O)C(=O)O.O=[V]
InChIInChI=1S/C6H8O7.H3N.O.V/c7-3(8)1-6(13,5(11)12)2-4(9)10;;;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);1H3;;
InChIKeyRLCCNEHFZXYDLQ-UHFFFAOYSA-N
MW276.10 g/mol
LogP-1.21
Rot. Bonds5

About azane;2-hydroxypropane-1,2,3-tricarboxylic acid;oxovanadium

azane;2-hydroxypropane-1,2,3-tricarboxylic acid;oxovanadium (PubChem CID 174576062) has the molecular formula C6H11NO8V and a molecular weight of 276.10 g/mol. Its IUPAC name is azane;2-hydroxypropane-1,2,3-tricarboxylic acid;oxovanadium.

Molecular Properties

Compound Nameazane;2-hydroxypropane-1,2,3-tricarboxylic acid;oxovanadium
PubChem CID174576062
Molecular FormulaC6H11NO8V
Molecular Weight276.10 g/mol
Exact Mass275.99
IUPAC Nameazane;2-hydroxypropane-1,2,3-tricarboxylic acid;oxovanadium
SMILESN.O=C(O)CC(O)(CC(=O)O)C(=O)O.O=[V]
InChIInChI=1S/C6H8O7.H3N.O.V/c7-3(8)1-6(13,5(11)12)2-4(9)10;;;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);1H3;;
InChIKeyRLCCNEHFZXYDLQ-UHFFFAOYSA-N
XLogP-1.21
TPSA184.20 Ų
H-Bond Donors5
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.10
LogP ≤ 5-1.21
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of azane;2-hydroxypropane-1,2,3-tricarboxylic acid;oxovanadium?
The IUPAC name of azane;2-hydroxypropane-1,2,3-tricarboxylic acid;oxovanadium (CID 174576062) is azane;2-hydroxypropane-1,2,3-tricarboxylic acid;oxovanadium.
What is the SMILES notation for azane;2-hydroxypropane-1,2,3-tricarboxylic acid;oxovanadium?
The canonical SMILES for azane;2-hydroxypropane-1,2,3-tricarboxylic acid;oxovanadium is N.O=C(O)CC(O)(CC(=O)O)C(=O)O.O=[V].
What is the InChIKey of azane;2-hydroxypropane-1,2,3-tricarboxylic acid;oxovanadium?
The InChIKey is RLCCNEHFZXYDLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8O7.H3N.O.V/c7-3(8)1-6(13,5(11)12)2-4(9)10;;;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);1H3;;.
What are the key properties of azane;2-hydroxypropane-1,2,3-tricarboxylic acid;oxovanadium?
azane;2-hydroxypropane-1,2,3-tricarboxylic acid;oxovanadium has a molecular weight of 276.10 g/mol, XLogP of -1.21, 5 rotatable bonds, 5 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for azane;2-hydroxypropane-1,2,3-tricarboxylic acid;oxovanadium is sourced from PubChem (CID 174576062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).