disodium;hydrogen borate;hydroxy-(hydroxy(dioxo)chromio)oxy-dioxochromium

H3BCr2Na2O10 — CID 175053649

IUPACdisodium;hydrogen borate;hydroxy-(hydroxy(dioxo)chromio)oxy-dioxochromium
SMILESO=[Cr](=O)(O)O[Cr](=O)(=O)O.[Na+].[Na+].[O-]B([O-])O
InChIInChI=1S/BHO3.2Cr.2Na.2H2O.5O/c2-1(3)4;;;;;;;;;;;/h2H;;;;;2*1H2;;;;;/q-2;4*+1;;;;;;;/p-2
InChIKeyCELPDAHDNTUGFB-UHFFFAOYSA-L
MW323.80 g/mol
LogP-10.97
Rot. Bonds2

About disodium;hydrogen borate;hydroxy-(hydroxy(dioxo)chromio)oxy-dioxochromium

disodium;hydrogen borate;hydroxy-(hydroxy(dioxo)chromio)oxy-dioxochromium (PubChem CID 175053649) has the molecular formula H3BCr2Na2O10 and a molecular weight of 323.80 g/mol. Its IUPAC name is disodium;hydrogen borate;hydroxy-(hydroxy(dioxo)chromio)oxy-dioxochromium.

Molecular Properties

Compound Namedisodium;hydrogen borate;hydroxy-(hydroxy(dioxo)chromio)oxy-dioxochromium
PubChem CID175053649
Molecular FormulaH3BCr2Na2O10
Molecular Weight323.80 g/mol
Exact Mass323.84
IUPAC Namedisodium;hydrogen borate;hydroxy-(hydroxy(dioxo)chromio)oxy-dioxochromium
SMILESO=[Cr](=O)(O)O[Cr](=O)(=O)O.[Na+].[Na+].[O-]B([O-])O
InChIInChI=1S/BHO3.2Cr.2Na.2H2O.5O/c2-1(3)4;;;;;;;;;;;/h2H;;;;;2*1H2;;;;;/q-2;4*+1;;;;;;;/p-2
InChIKeyCELPDAHDNTUGFB-UHFFFAOYSA-L
XLogP-10.97
TPSA184.32 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.80
LogP ≤ 5-10.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

hydroxy-(hydroxy(dioxo)chromio)oxy-dioxochromium;hexahydrate
CID 173388607
hydroxy-(hydroxy(dioxo)chromio)oxy-dioxochromium;iron
CID 158967900
potassium;sodium;hydroxy-(hydroxy(dioxo)chromio)oxy-dioxochromium;sulfite
CID 159107415
sodium;hydroxy-(hydroxy(dioxo)chromio)oxy-dioxochromium;sulfuric acid;fluoride
CID 173135445
potassium;sodium;hydroxy-(oxido(dioxo)chromio)oxy-dioxochromium;bromide
CID 159383711
disodium;hydrogen borate
CID 14496929
disodium;hydrogen borate;hexahydrate
CID 158511023
lithium;sodium;boric acid;hydrogen borate
CID 157067915
potassium;sodium;carbonic acid;hydrogen borate
CID 157407126
hydroxy-(hydroxy(dioxo)chromio)oxy-dioxochromium;bis(pyrimidine)
CID 172732059
dilithium;disodium;boric acid;hydrogen borate;dihydroxide
CID 172686380
sodium;azane;dihydrogen borate
CID 172687370

Frequently Asked Questions

What is the IUPAC name of disodium;hydrogen borate;hydroxy-(hydroxy(dioxo)chromio)oxy-dioxochromium?
The IUPAC name of disodium;hydrogen borate;hydroxy-(hydroxy(dioxo)chromio)oxy-dioxochromium (CID 175053649) is disodium;hydrogen borate;hydroxy-(hydroxy(dioxo)chromio)oxy-dioxochromium.
What is the SMILES notation for disodium;hydrogen borate;hydroxy-(hydroxy(dioxo)chromio)oxy-dioxochromium?
The canonical SMILES for disodium;hydrogen borate;hydroxy-(hydroxy(dioxo)chromio)oxy-dioxochromium is O=[Cr](=O)(O)O[Cr](=O)(=O)O.[Na+].[Na+].[O-]B([O-])O.
What is the InChIKey of disodium;hydrogen borate;hydroxy-(hydroxy(dioxo)chromio)oxy-dioxochromium?
The InChIKey is CELPDAHDNTUGFB-UHFFFAOYSA-L. The full InChI is InChI=1S/BHO3.2Cr.2Na.2H2O.5O/c2-1(3)4;;;;;;;;;;;/h2H;;;;;2*1H2;;;;;/q-2;4*+1;;;;;;;/p-2.
What are the key properties of disodium;hydrogen borate;hydroxy-(hydroxy(dioxo)chromio)oxy-dioxochromium?
disodium;hydrogen borate;hydroxy-(hydroxy(dioxo)chromio)oxy-dioxochromium has a molecular weight of 323.80 g/mol, XLogP of -10.97, 2 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for disodium;hydrogen borate;hydroxy-(hydroxy(dioxo)chromio)oxy-dioxochromium is sourced from PubChem (CID 175053649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).