19,19-diphenylnonadecyl dihydrogen phosphite

C31H49O3P — CID 19792274

IUPAC19,19-diphenylnonadecyl dihydrogen phosphite
SMILESOP(O)OCCCCCCCCCCCCCCCCCCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C31H49O3P/c32-35(33)34-28-22-14-12-10-8-6-4-2-1-3-5-7-9-11-13-21-27-31(29-23-17-15-18-24-29)30-25-19-16-20-26-30/h15-20,23-26,31-33H,1-14,21-22,27-28H2
InChIKeyGUVOUWRTDAXCFM-UHFFFAOYSA-N
MW500.70 g/mol
LogP9.68
Rot. Bonds22

About 19,19-diphenylnonadecyl dihydrogen phosphite

19,19-diphenylnonadecyl dihydrogen phosphite (PubChem CID 19792274) has the molecular formula C31H49O3P and a molecular weight of 500.70 g/mol. Its IUPAC name is 19,19-diphenylnonadecyl dihydrogen phosphite.

Molecular Properties

Compound Name19,19-diphenylnonadecyl dihydrogen phosphite
PubChem CID19792274
Molecular FormulaC31H49O3P
Molecular Weight500.70 g/mol
Exact Mass500.34
IUPAC Name19,19-diphenylnonadecyl dihydrogen phosphite
SMILESOP(O)OCCCCCCCCCCCCCCCCCCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C31H49O3P/c32-35(33)34-28-22-14-12-10-8-6-4-2-1-3-5-7-9-11-13-21-27-31(29-23-17-15-18-24-29)30-25-19-16-20-26-30/h15-20,23-26,31-33H,1-14,21-22,27-28H2
InChIKeyGUVOUWRTDAXCFM-UHFFFAOYSA-N
XLogP9.68
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds22
Heavy Atoms35
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500500.70
LogP ≤ 59.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

10-phenyldodecyl dihydrogen phosphite
CID 154182802
12,12-diphenyldodecyl phenyl hydrogen phosphite
CID 70542375
12,12-diphenyldodecyl(trihydroxy)phosphanium
CID 66694525
6,6-diphenylhexyl dihydrogen phosphate
CID 139923067
6-ethyloctyl dihydrogen phosphite
CID 141350214
4-(5-phenoxy-1-phenylpentyl)pyridine
CID 117067769
4,4-diphenylbutoxy-[4-(4,4-diphenylbutoxysilyl)phenyl]silane
CID 154430428
2-(8,8-diphenyloctyl)phenol
CID 66867292
2-(7,7-diphenylheptyl)phenol
CID 66866981
bis(6-methylheptyl) hydrogen phosphite;1,2-xylene
CID 175467030
4,4-diphenylbutoxy-dihydroxy-sulfanylidene-λ5-phosphane
CID 54339531
2-acetyl-10,10-diphenyldecanoic acid
CID 69432252

Frequently Asked Questions

What is the IUPAC name of 19,19-diphenylnonadecyl dihydrogen phosphite?
The IUPAC name of 19,19-diphenylnonadecyl dihydrogen phosphite (CID 19792274) is 19,19-diphenylnonadecyl dihydrogen phosphite.
What is the SMILES notation for 19,19-diphenylnonadecyl dihydrogen phosphite?
The canonical SMILES for 19,19-diphenylnonadecyl dihydrogen phosphite is OP(O)OCCCCCCCCCCCCCCCCCCC(c1ccccc1)c1ccccc1.
What is the InChIKey of 19,19-diphenylnonadecyl dihydrogen phosphite?
The InChIKey is GUVOUWRTDAXCFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H49O3P/c32-35(33)34-28-22-14-12-10-8-6-4-2-1-3-5-7-9-11-13-21-27-31(29-23-17-15-18-24-29)30-25-19-16-20-26-30/h15-20,23-26,31-33H,1-14,21-22,27-28H2.
What are the key properties of 19,19-diphenylnonadecyl dihydrogen phosphite?
19,19-diphenylnonadecyl dihydrogen phosphite has a molecular weight of 500.70 g/mol, XLogP of 9.68, 22 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 19,19-diphenylnonadecyl dihydrogen phosphite is sourced from PubChem (CID 19792274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).