CID 87374991

C5H11O2Sn — CID 87374991

IUPAC—
SMILESCCCCCO[Sn]=O
InChIInChI=1S/C5H11O.O.Sn/c1-2-3-4-5-6;;/h2-5H2,1H3;;/q-1;;+1
InChIKeySJQOVVFUOKEZID-UHFFFAOYSA-N
MW221.85 g/mol
LogP1.16
Rot. Bonds5

About CID 87374991

CID 87374991 (PubChem CID 87374991) has the molecular formula C5H11O2Sn and a molecular weight of 221.85 g/mol.

Molecular Properties

Compound NameCID 87374991
PubChem CID87374991
Molecular FormulaC5H11O2Sn
Molecular Weight221.85 g/mol
Exact Mass222.98
IUPAC Name—
SMILESCCCCCO[Sn]=O
InChIInChI=1S/C5H11O.O.Sn/c1-2-3-4-5-6;;/h2-5H2,1H3;;/q-1;;+1
InChIKeySJQOVVFUOKEZID-UHFFFAOYSA-N
XLogP1.16
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.85
LogP ≤ 51.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

chloro(octadecoxy)tin;hydrate
CID 88816553
hexane;oxomercury
CID 174814256
hexadecoxy(oxo)phosphanium
CID 123281757
nonan-5-yl(nonoxy)tin
CID 87371420
methane;pentyl methanesulfonate
CID 158804088
cobalt(2+);heptoxy(oxo)phosphanium
CID 157228735
1-(7-tetradecoxyheptoxy)tetradecane
CID 139884729
1-hexacosoxyhexacosane
CID 56611156
1-dodecoxyhexadecane
CID 22256973
1-decoxydocosane
CID 87077677
pentoxyphosphanium
CID 151109139
dodecylmercury;hydrate
CID 78070234

Frequently Asked Questions

What is the IUPAC name of CID 87374991?
The IUPAC name of CID 87374991 (CID 87374991) is not available.
What is the SMILES notation for CID 87374991?
The canonical SMILES for CID 87374991 is CCCCCO[Sn]=O.
What is the InChIKey of CID 87374991?
The InChIKey is SJQOVVFUOKEZID-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11O.O.Sn/c1-2-3-4-5-6;;/h2-5H2,1H3;;/q-1;;+1.
What are the key properties of CID 87374991?
CID 87374991 has a molecular weight of 221.85 g/mol, XLogP of 1.16, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 87374991 is sourced from PubChem (CID 87374991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).