(3,4-difluoro-2-methylphenyl)phosphane

C7H7F2P — CID 178005158

IUPAC(3,4-difluoro-2-methylphenyl)phosphane
SMILESCc1c(P)ccc(F)c1F
InChIInChI=1S/C7H7F2P/c1-4-6(10)3-2-5(8)7(4)9/h2-3H,10H2,1H3
InChIKeyCMBXHVZRSSQDEW-UHFFFAOYSA-N
MW160.10 g/mol
LogP1.77
Rot. Bonds

About (3,4-difluoro-2-methylphenyl)phosphane

(3,4-difluoro-2-methylphenyl)phosphane (PubChem CID 178005158) has the molecular formula C7H7F2P and a molecular weight of 160.10 g/mol. Its IUPAC name is (3,4-difluoro-2-methylphenyl)phosphane.

Molecular Properties

Compound Name(3,4-difluoro-2-methylphenyl)phosphane
PubChem CID178005158
Molecular FormulaC7H7F2P
Molecular Weight160.10 g/mol
Exact Mass160.03
IUPAC Name(3,4-difluoro-2-methylphenyl)phosphane
SMILESCc1c(P)ccc(F)c1F
InChIInChI=1S/C7H7F2P/c1-4-6(10)3-2-5(8)7(4)9/h2-3H,10H2,1H3
InChIKeyCMBXHVZRSSQDEW-UHFFFAOYSA-N
XLogP1.77
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.10
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(3-chloro-4-fluoro-2-methylphenyl)phosphane
CID 178005191
(4-fluoro-3-methyl-2-propan-2-ylphenyl)phosphane
CID 143190268
3,4-difluoro-2-methylaniline;ethane
CID 143670035
(2,3,4-trimethylphenyl)phosphane
CID 19864163
(2,3,4-trimethylphenyl)phosphane;hydrochloride
CID 173157555
(2,3,4-trifluorophenyl)phosphane;(2,3,5-trifluorophenyl)phosphane
CID 143472121
1-(2-chloroethyl)-3,4-difluoro-2-methylbenzene
CID 130139628
N-(3,4-difluoro-2-methylphenyl)acetamide
CID 15692403
ethane;1,2,4,5-tetrafluoro-3-methylbenzene
CID 143259717
1,3-dichloro-4-fluoro-2-methylbenzene
CID 11830014
2-(3,4-difluoro-2-methylphenyl)-2-hydroxyacetic acid
CID 131032215
N-[(3,4-difluoro-2-methylphenyl)-fluoromethyl]propanamide
CID 175322647

Frequently Asked Questions

What is the IUPAC name of (3,4-difluoro-2-methylphenyl)phosphane?
The IUPAC name of (3,4-difluoro-2-methylphenyl)phosphane (CID 178005158) is (3,4-difluoro-2-methylphenyl)phosphane.
What is the SMILES notation for (3,4-difluoro-2-methylphenyl)phosphane?
The canonical SMILES for (3,4-difluoro-2-methylphenyl)phosphane is Cc1c(P)ccc(F)c1F.
What is the InChIKey of (3,4-difluoro-2-methylphenyl)phosphane?
The InChIKey is CMBXHVZRSSQDEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F2P/c1-4-6(10)3-2-5(8)7(4)9/h2-3H,10H2,1H3.
What are the key properties of (3,4-difluoro-2-methylphenyl)phosphane?
(3,4-difluoro-2-methylphenyl)phosphane has a molecular weight of 160.10 g/mol, XLogP of 1.77, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-difluoro-2-methylphenyl)phosphane is sourced from PubChem (CID 178005158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).