CID 88654281

C3H7AlClO3 — CID 88654281

IUPAC—
SMILESOCC(O)COCl.[Al]
InChIInChI=1S/C3H7ClO3.Al/c4-7-2-3(6)1-5;/h3,5-6H,1-2H2;
InChIKeySPRUYMLSUNKMCX-UHFFFAOYSA-N
MW153.52 g/mol
LogP-0.87
Rot. Bonds3

About CID 88654281

CID 88654281 (PubChem CID 88654281) has the molecular formula C3H7AlClO3 and a molecular weight of 153.52 g/mol.

Molecular Properties

Compound NameCID 88654281
PubChem CID88654281
Molecular FormulaC3H7AlClO3
Molecular Weight153.52 g/mol
Exact Mass152.99
IUPAC Name—
SMILESOCC(O)COCl.[Al]
InChIInChI=1S/C3H7ClO3.Al/c4-7-2-3(6)1-5;/h3,5-6H,1-2H2;
InChIKeySPRUYMLSUNKMCX-UHFFFAOYSA-N
XLogP-0.87
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.52
LogP ≤ 5-0.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-dihydroxypropyl hypochlorite
CID 54142459
(3-amino-2-hydroxypropyl) hypochlorite
CID 129235335
3-(2,3-dihydroxypropoxy)propane-1,2-diol;propane-1,2,3-triol
CID 87090459
[(2R)-2-hydroxy-3-methoxypropyl] hypochlorite
CID 129235320
3-(2,3-dihydroxypropoxymethoxy)propane-1,2-diol
CID 59854090
magnesium;3-(2,3-dihydroxypropoxy)propane-1,2-diol;dichloride
CID 174372262
2,3-dihydroxypropyl hypobromite
CID 23618335
acetic acid;3-(2,3-dihydroxypropoxy)propane-1,2-diol
CID 161329261
3-methoxypropane-1,2-diol;dihydrochloride
CID 87908148
3-alumanyloxypropane-1,2-diol;hydrate
CID 175040136
acetic acid;3-methoxypropane-1,2-diol
CID 71422269
chloro 2,3-dihydroxypropyl phosphate
CID 22670557

Frequently Asked Questions

What is the IUPAC name of CID 88654281?
The IUPAC name of CID 88654281 (CID 88654281) is not available.
What is the SMILES notation for CID 88654281?
The canonical SMILES for CID 88654281 is OCC(O)COCl.[Al].
What is the InChIKey of CID 88654281?
The InChIKey is SPRUYMLSUNKMCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7ClO3.Al/c4-7-2-3(6)1-5;/h3,5-6H,1-2H2;.
What are the key properties of CID 88654281?
CID 88654281 has a molecular weight of 153.52 g/mol, XLogP of -0.87, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 88654281 is sourced from PubChem (CID 88654281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).