3-phosphanylidenepropan-1-ol

C3H7OP — CID 173494272

IUPAC3-phosphanylidenepropan-1-ol
SMILES[H]/P=C/CCO
InChIInChI=1S/C3H7OP/c4-2-1-3-5/h3-5H,1-2H2
InChIKeyPDWJXAIJHKPIBC-UHFFFAOYSA-N
MW90.06 g/mol
LogP0.31
Rot. Bonds2

About 3-phosphanylidenepropan-1-ol

3-phosphanylidenepropan-1-ol (PubChem CID 173494272) has the molecular formula C3H7OP and a molecular weight of 90.06 g/mol. Its IUPAC name is 3-phosphanylidenepropan-1-ol.

Molecular Properties

Compound Name3-phosphanylidenepropan-1-ol
PubChem CID173494272
Molecular FormulaC3H7OP
Molecular Weight90.06 g/mol
Exact Mass90.02
IUPAC Name3-phosphanylidenepropan-1-ol
SMILES[H]/P=C/CCO
InChIInChI=1S/C3H7OP/c4-2-1-3-5/h3-5H,1-2H2
InChIKeyPDWJXAIJHKPIBC-UHFFFAOYSA-N
XLogP0.31
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50090.06
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-phosphanylidenepropane-1-thiol
CID 167226781
3-hydroxypropanal;hydrochloride
CID 87570947
but-3-en-1-ol;silane
CID 174710612
(E)-7-bromohept-3-en-1-ol
CID 163205000
4,4-difluorobut-3-en-1-ol
CID 14855882
sodium;but-3-en-1-ol;hydride
CID 174719957
(E)-4-iodobut-3-en-1-ol
CID 10821775
(E)-oct-5-ene-1,2,8-triol
CID 20554578
1,1-dihydroxy-3-(3-hydroxypropylidene)urea
CID 154128870
(Z)-4-[3,5-bis(trifluoromethyl)phenyl]but-3-en-1-ol
CID 118168632
2-(3-hydroxypropylidene)propanedial
CID 141350211
N-(3-hydroxypropylidene)formamide
CID 59877766

Frequently Asked Questions

What is the IUPAC name of 3-phosphanylidenepropan-1-ol?
The IUPAC name of 3-phosphanylidenepropan-1-ol (CID 173494272) is 3-phosphanylidenepropan-1-ol.
What is the SMILES notation for 3-phosphanylidenepropan-1-ol?
The canonical SMILES for 3-phosphanylidenepropan-1-ol is [H]/P=C/CCO.
What is the InChIKey of 3-phosphanylidenepropan-1-ol?
The InChIKey is PDWJXAIJHKPIBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7OP/c4-2-1-3-5/h3-5H,1-2H2.
What are the key properties of 3-phosphanylidenepropan-1-ol?
3-phosphanylidenepropan-1-ol has a molecular weight of 90.06 g/mol, XLogP of 0.31, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phosphanylidenepropan-1-ol is sourced from PubChem (CID 173494272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).