ethyl dihydrogen phosphite;bis(N-ethylethanamine)

C10H29N2O3P — CID 172732787

IUPACethyl dihydrogen phosphite;bis(N-ethylethanamine)
SMILESCCNCC.CCNCC.CCOP(O)O
InChIInChI=1S/2C4H11N.C2H7O3P/c2*1-3-5-4-2;1-2-5-6(3)4/h2*5H,3-4H2,1-2H3;3-4H,2H2,1H3
InChIKeyIAEZLVMJZGIIID-UHFFFAOYSA-N
MW256.33 g/mol
LogP1.47
Rot. Bonds6

About ethyl dihydrogen phosphite;bis(N-ethylethanamine)

ethyl dihydrogen phosphite;bis(N-ethylethanamine) (PubChem CID 172732787) has the molecular formula C10H29N2O3P and a molecular weight of 256.33 g/mol. Its IUPAC name is ethyl dihydrogen phosphite;bis(N-ethylethanamine).

Molecular Properties

Compound Nameethyl dihydrogen phosphite;bis(N-ethylethanamine)
PubChem CID172732787
Molecular FormulaC10H29N2O3P
Molecular Weight256.33 g/mol
Exact Mass256.19
IUPAC Nameethyl dihydrogen phosphite;bis(N-ethylethanamine)
SMILESCCNCC.CCNCC.CCOP(O)O
InChIInChI=1S/2C4H11N.C2H7O3P/c2*1-3-5-4-2;1-2-5-6(3)4/h2*5H,3-4H2,1-2H3;3-4H,2H2,1H3
InChIKeyIAEZLVMJZGIIID-UHFFFAOYSA-N
XLogP1.47
TPSA73.75 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.33
LogP ≤ 51.47
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

ethyl dihydrogen phosphite;dihydrochloride
CID 88746637
N-(1,2-13C2)ethyl(1,2-13C2)ethanamine
CID 71309791
ethoxyethane;N-ethylethanamine
CID 21325293
diethyl hydrogen phosphite
CID 12977
diethyl hydrogen phosphite;mercury
CID 54602640
phosphorous acid;triethyl phosphite
CID 174300225
N-ethylethanamine;O-ethylhydroxylamine
CID 19097827
N-ethylethanamine;platinum
CID 88506582
N-ethylethanamine;yttrium
CID 174702634
N-ethylethanamine;λ2-plumbane
CID 174566138
cerium;N-ethylethanamine
CID 174691303
N-ethylethanamine;titanium(4+)
CID 21151065

Frequently Asked Questions

What is the IUPAC name of ethyl dihydrogen phosphite;bis(N-ethylethanamine)?
The IUPAC name of ethyl dihydrogen phosphite;bis(N-ethylethanamine) (CID 172732787) is ethyl dihydrogen phosphite;bis(N-ethylethanamine).
What is the SMILES notation for ethyl dihydrogen phosphite;bis(N-ethylethanamine)?
The canonical SMILES for ethyl dihydrogen phosphite;bis(N-ethylethanamine) is CCNCC.CCNCC.CCOP(O)O.
What is the InChIKey of ethyl dihydrogen phosphite;bis(N-ethylethanamine)?
The InChIKey is IAEZLVMJZGIIID-UHFFFAOYSA-N. The full InChI is InChI=1S/2C4H11N.C2H7O3P/c2*1-3-5-4-2;1-2-5-6(3)4/h2*5H,3-4H2,1-2H3;3-4H,2H2,1H3.
What are the key properties of ethyl dihydrogen phosphite;bis(N-ethylethanamine)?
ethyl dihydrogen phosphite;bis(N-ethylethanamine) has a molecular weight of 256.33 g/mol, XLogP of 1.47, 6 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl dihydrogen phosphite;bis(N-ethylethanamine) is sourced from PubChem (CID 172732787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).