bis(2-bromophenyl)-[4-(9,9-dimethylacridin-10-yl)phenyl]phosphane

C33H26Br2NP — CID 139317565

IUPACbis(2-bromophenyl)-[4-(9,9-dimethylacridin-10-yl)phenyl]phosphane
SMILESCC1(C)c2ccccc2N(c2ccc(P(c3ccccc3Br)c3ccccc3Br)cc2)c2ccccc21
InChIInChI=1S/C33H26Br2NP/c1-33(2)25-11-3-7-15-29(25)36(30-16-8-4-12-26(30)33)23-19-21-24(22-20-23)37(31-17-9-5-13-27(31)34)32-18-10-6-14-28(32)35/h3-22H,1-2H3
InChIKeyVHJDSWZXPHLDOA-UHFFFAOYSA-N
MW627.36 g/mol
LogP9.08
Rot. Bonds4

About bis(2-bromophenyl)-[4-(9,9-dimethylacridin-10-yl)phenyl]phosphane

bis(2-bromophenyl)-[4-(9,9-dimethylacridin-10-yl)phenyl]phosphane (PubChem CID 139317565) has the molecular formula C33H26Br2NP and a molecular weight of 627.36 g/mol. Its IUPAC name is bis(2-bromophenyl)-[4-(9,9-dimethylacridin-10-yl)phenyl]phosphane.

Molecular Properties

Compound Namebis(2-bromophenyl)-[4-(9,9-dimethylacridin-10-yl)phenyl]phosphane
PubChem CID139317565
Molecular FormulaC33H26Br2NP
Molecular Weight627.36 g/mol
Exact Mass625.02
IUPAC Namebis(2-bromophenyl)-[4-(9,9-dimethylacridin-10-yl)phenyl]phosphane
SMILESCC1(C)c2ccccc2N(c2ccc(P(c3ccccc3Br)c3ccccc3Br)cc2)c2ccccc21
InChIInChI=1S/C33H26Br2NP/c1-33(2)25-11-3-7-15-29(25)36(30-16-8-4-12-26(30)33)23-19-21-24(22-20-23)37(31-17-9-5-13-27(31)34)32-18-10-6-14-28(32)35/h3-22H,1-2H3
InChIKeyVHJDSWZXPHLDOA-UHFFFAOYSA-N
XLogP9.08
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500627.36
LogP ≤ 59.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

8-(4-bromophenyl)-14,14-dimethyl-1,8-diazapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene
CID 141487982
9,9-dimethyl-10-[4-(9-methylcarbazol-3-yl)phenyl]acridine
CID 130353436
10-[4-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,9-dimethylacridine
CID 118528442
9,9-dimethyl-10-[4-[2,6,7-tris(4-phenylphenyl)pyrazino[2,3-b]pyrazin-3-yl]phenyl]acridine
CID 129037640
3-(9,9-dimethyl-10-phenylacridin-3-yl)-9,9-dimethyl-10-phenylacridine
CID 58489784
9,9-dimethyl-10-(6-methyl-3-pyridinyl)acridine
CID 118881708
14,14-dimethyl-8-phenyl-1,8-diazapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene
CID 118443210
[3,5-bis[4-(9,9-dimethylacridin-10-yl)benzoyl]phenyl]-[4-(9,9-dimethylacridin-10-yl)phenyl]methanone
CID 121420430
10-[4-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-9,9-dimethylacridine
CID 118528441
2,9,9-trimethyl-10-[4-[4-(2,9,9-trimethylacridin-10-yl)phenyl]sulfonylphenyl]acridine
CID 132504403
10-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethylacridine
CID 155244755
10-(6-bromo-2-pyridinyl)-9,9-dimethylacridine
CID 134194197

Frequently Asked Questions

What is the IUPAC name of bis(2-bromophenyl)-[4-(9,9-dimethylacridin-10-yl)phenyl]phosphane?
The IUPAC name of bis(2-bromophenyl)-[4-(9,9-dimethylacridin-10-yl)phenyl]phosphane (CID 139317565) is bis(2-bromophenyl)-[4-(9,9-dimethylacridin-10-yl)phenyl]phosphane.
What is the SMILES notation for bis(2-bromophenyl)-[4-(9,9-dimethylacridin-10-yl)phenyl]phosphane?
The canonical SMILES for bis(2-bromophenyl)-[4-(9,9-dimethylacridin-10-yl)phenyl]phosphane is CC1(C)c2ccccc2N(c2ccc(P(c3ccccc3Br)c3ccccc3Br)cc2)c2ccccc21.
What is the InChIKey of bis(2-bromophenyl)-[4-(9,9-dimethylacridin-10-yl)phenyl]phosphane?
The InChIKey is VHJDSWZXPHLDOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H26Br2NP/c1-33(2)25-11-3-7-15-29(25)36(30-16-8-4-12-26(30)33)23-19-21-24(22-20-23)37(31-17-9-5-13-27(31)34)32-18-10-6-14-28(32)35/h3-22H,1-2H3.
What are the key properties of bis(2-bromophenyl)-[4-(9,9-dimethylacridin-10-yl)phenyl]phosphane?
bis(2-bromophenyl)-[4-(9,9-dimethylacridin-10-yl)phenyl]phosphane has a molecular weight of 627.36 g/mol, XLogP of 9.08, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-bromophenyl)-[4-(9,9-dimethylacridin-10-yl)phenyl]phosphane is sourced from PubChem (CID 139317565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).