(7-methylnaphthalen-1-yl)phosphane;hydrochloride

C11H12ClP — CID 175192876

IUPAC(7-methylnaphthalen-1-yl)phosphane;hydrochloride
SMILESCc1ccc2cccc(P)c2c1.Cl
InChIInChI=1S/C11H11P.ClH/c1-8-5-6-9-3-2-4-11(12)10(9)7-8;/h2-7H,12H2,1H3;1H
InChIKeyAQVKDDWFDCLHPT-UHFFFAOYSA-N
MW210.64 g/mol
LogP3.07
Rot. Bonds

About (7-methylnaphthalen-1-yl)phosphane;hydrochloride

(7-methylnaphthalen-1-yl)phosphane;hydrochloride (PubChem CID 175192876) has the molecular formula C11H12ClP and a molecular weight of 210.64 g/mol. Its IUPAC name is (7-methylnaphthalen-1-yl)phosphane;hydrochloride.

Molecular Properties

Compound Name(7-methylnaphthalen-1-yl)phosphane;hydrochloride
PubChem CID175192876
Molecular FormulaC11H12ClP
Molecular Weight210.64 g/mol
Exact Mass210.04
IUPAC Name(7-methylnaphthalen-1-yl)phosphane;hydrochloride
SMILESCc1ccc2cccc(P)c2c1.Cl
InChIInChI=1S/C11H11P.ClH/c1-8-5-6-9-3-2-4-11(12)10(9)7-8;/h2-7H,12H2,1H3;1H
InChIKeyAQVKDDWFDCLHPT-UHFFFAOYSA-N
XLogP3.07
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.64
LogP ≤ 53.07
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

1-ethyl-7-methylnaphthalene
CID 12778771
azane;1-fluoro-7-methylnaphthalene
CID 174703926
ethane;1-ethyl-7-methylnaphthalene
CID 91014752
2,9-dimethylnaphtho[1,2-b]phenanthrene
CID 58426646
7-methylnaphthalene-1-carbaldehyde
CID 15657410
ethane;7-methyl-1-propan-2-ylnaphthalene
CID 177009970
2,9-dimethylpicene
CID 15509
[2-(4-methylphenyl)quinolin-8-yl]phosphane
CID 140733063
7-methylnaphthalene-1-sulfinic acid
CID 71250211
molecular hydrogen;naphthalen-1-ylphosphane
CID 174185570
1,6-dimethylphenanthrene;ethane
CID 144939314
5-methylhexacyclo[16.8.0.02,11.03,8.012,17.019,24]hexacosa-1(18),2(11),3(8),4,6,9,12,14,16,19,21,23,25-tridecaene
CID 11057003

Frequently Asked Questions

What is the IUPAC name of (7-methylnaphthalen-1-yl)phosphane;hydrochloride?
The IUPAC name of (7-methylnaphthalen-1-yl)phosphane;hydrochloride (CID 175192876) is (7-methylnaphthalen-1-yl)phosphane;hydrochloride.
What is the SMILES notation for (7-methylnaphthalen-1-yl)phosphane;hydrochloride?
The canonical SMILES for (7-methylnaphthalen-1-yl)phosphane;hydrochloride is Cc1ccc2cccc(P)c2c1.Cl.
What is the InChIKey of (7-methylnaphthalen-1-yl)phosphane;hydrochloride?
The InChIKey is AQVKDDWFDCLHPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11P.ClH/c1-8-5-6-9-3-2-4-11(12)10(9)7-8;/h2-7H,12H2,1H3;1H.
What are the key properties of (7-methylnaphthalen-1-yl)phosphane;hydrochloride?
(7-methylnaphthalen-1-yl)phosphane;hydrochloride has a molecular weight of 210.64 g/mol, XLogP of 3.07, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (7-methylnaphthalen-1-yl)phosphane;hydrochloride is sourced from PubChem (CID 175192876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).