acetic acid;chromium;ethane-1,2-diamine

C10H24CrN2O8 — CID 157437445

IUPACacetic acid;chromium;ethane-1,2-diamine
SMILESCC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.NCCN.[Cr]
InChIInChI=1S/C2H8N2.4C2H4O2.Cr/c3-1-2-4;4*1-2(3)4;/h1-4H2;4*1H3,(H,3,4);
InChIKeyBRGUHULNOYQCOW-UHFFFAOYSA-N
MW352.30 g/mol
LogP-0.74
Rot. Bonds1

About acetic acid;chromium;ethane-1,2-diamine

acetic acid;chromium;ethane-1,2-diamine (PubChem CID 157437445) has the molecular formula C10H24CrN2O8 and a molecular weight of 352.30 g/mol. Its IUPAC name is acetic acid;chromium;ethane-1,2-diamine.

Molecular Properties

Compound Nameacetic acid;chromium;ethane-1,2-diamine
PubChem CID157437445
Molecular FormulaC10H24CrN2O8
Molecular Weight352.30 g/mol
Exact Mass352.09
IUPAC Nameacetic acid;chromium;ethane-1,2-diamine
SMILESCC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.NCCN.[Cr]
InChIInChI=1S/C2H8N2.4C2H4O2.Cr/c3-1-2-4;4*1-2(3)4;/h1-4H2;4*1H3,(H,3,4);
InChIKeyBRGUHULNOYQCOW-UHFFFAOYSA-N
XLogP-0.74
TPSA201.24 Ų
H-Bond Donors6
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms21
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.30
LogP ≤ 5-0.74
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of acetic acid;chromium;ethane-1,2-diamine?
The IUPAC name of acetic acid;chromium;ethane-1,2-diamine (CID 157437445) is acetic acid;chromium;ethane-1,2-diamine.
What is the SMILES notation for acetic acid;chromium;ethane-1,2-diamine?
The canonical SMILES for acetic acid;chromium;ethane-1,2-diamine is CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.NCCN.[Cr].
What is the InChIKey of acetic acid;chromium;ethane-1,2-diamine?
The InChIKey is BRGUHULNOYQCOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H8N2.4C2H4O2.Cr/c3-1-2-4;4*1-2(3)4;/h1-4H2;4*1H3,(H,3,4);.
What are the key properties of acetic acid;chromium;ethane-1,2-diamine?
acetic acid;chromium;ethane-1,2-diamine has a molecular weight of 352.30 g/mol, XLogP of -0.74, 1 rotatable bonds, 6 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for acetic acid;chromium;ethane-1,2-diamine is sourced from PubChem (CID 157437445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).