(3,6-dibromo-10-phosphanylphenanthren-9-yl)phosphane

C14H10Br2P2 — CID 89338350

IUPAC(3,6-dibromo-10-phosphanylphenanthren-9-yl)phosphane
SMILESPc1c(P)c2ccc(Br)cc2c2cc(Br)ccc12
InChIInChI=1S/C14H10Br2P2/c15-7-1-3-9-11(5-7)12-6-8(16)2-4-10(12)14(18)13(9)17/h1-6H,17-18H2
InChIKeyPRHJGXZSJZRQOO-UHFFFAOYSA-N
MW399.99 g/mol
LogP4.52
Rot. Bonds

About (3,6-dibromo-10-phosphanylphenanthren-9-yl)phosphane

(3,6-dibromo-10-phosphanylphenanthren-9-yl)phosphane (PubChem CID 89338350) has the molecular formula C14H10Br2P2 and a molecular weight of 399.99 g/mol. Its IUPAC name is (3,6-dibromo-10-phosphanylphenanthren-9-yl)phosphane.

Molecular Properties

Compound Name(3,6-dibromo-10-phosphanylphenanthren-9-yl)phosphane
PubChem CID89338350
Molecular FormulaC14H10Br2P2
Molecular Weight399.99 g/mol
Exact Mass397.86
IUPAC Name(3,6-dibromo-10-phosphanylphenanthren-9-yl)phosphane
SMILESPc1c(P)c2ccc(Br)cc2c2cc(Br)ccc12
InChIInChI=1S/C14H10Br2P2/c15-7-1-3-9-11(5-7)12-6-8(16)2-4-10(12)14(18)13(9)17/h1-6H,17-18H2
InChIKeyPRHJGXZSJZRQOO-UHFFFAOYSA-N
XLogP4.52
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.99
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

3,6-dibromobenzo[b]triphenylene
CID 155269401
6-bromo-1,2,3,4-tetrafluoronaphthalene
CID 59658286
1,4,6-tribromophthalazine
CID 162731871
10,21-dibromopentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8(13),9,11,15,17,19,21-undecaene
CID 89308355
7,10-dibromo-1,4-diphenyltriphenylene
CID 142691015
6,10-dibromophenanthren-9-amine
CID 171782215
10-bromophenanthro[9,10-b]pyrazine
CID 58224572
2,6-dibromoanthracene-9,10-dicarboxylic acid
CID 141473473
2-bromotriphenylene;triphenylen-2-ylboronic acid
CID 160518339
bis(7-bromotriphenylen-2-yl)methanethione
CID 146864022
sodium 2,7-dibromo-9H-fluoren-9-ide
CID 162767224
4,6-dibromo-1-(4,6-dibromo-2-hydroxynaphthalen-1-yl)naphthalen-2-ol
CID 10841304

Frequently Asked Questions

What is the IUPAC name of (3,6-dibromo-10-phosphanylphenanthren-9-yl)phosphane?
The IUPAC name of (3,6-dibromo-10-phosphanylphenanthren-9-yl)phosphane (CID 89338350) is (3,6-dibromo-10-phosphanylphenanthren-9-yl)phosphane.
What is the SMILES notation for (3,6-dibromo-10-phosphanylphenanthren-9-yl)phosphane?
The canonical SMILES for (3,6-dibromo-10-phosphanylphenanthren-9-yl)phosphane is Pc1c(P)c2ccc(Br)cc2c2cc(Br)ccc12.
What is the InChIKey of (3,6-dibromo-10-phosphanylphenanthren-9-yl)phosphane?
The InChIKey is PRHJGXZSJZRQOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Br2P2/c15-7-1-3-9-11(5-7)12-6-8(16)2-4-10(12)14(18)13(9)17/h1-6H,17-18H2.
What are the key properties of (3,6-dibromo-10-phosphanylphenanthren-9-yl)phosphane?
(3,6-dibromo-10-phosphanylphenanthren-9-yl)phosphane has a molecular weight of 399.99 g/mol, XLogP of 4.52, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3,6-dibromo-10-phosphanylphenanthren-9-yl)phosphane is sourced from PubChem (CID 89338350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).