4-(nitrosomethyl)phenol

C7H7NO2 — CID 54346225

IUPAC4-(nitrosomethyl)phenol
SMILESO=NCc1ccc(O)cc1
InChIInChI=1S/C7H7NO2/c9-7-3-1-6(2-4-7)5-8-10/h1-4,9H,5H2
InChIKeyUCMJYLGFDFZTDU-UHFFFAOYSA-N
MW137.14 g/mol
LogP1.66
Rot. Bonds2

About 4-(nitrosomethyl)phenol

4-(nitrosomethyl)phenol (PubChem CID 54346225) has the molecular formula C7H7NO2 and a molecular weight of 137.14 g/mol. Its IUPAC name is 4-(nitrosomethyl)phenol.

Molecular Properties

Compound Name4-(nitrosomethyl)phenol
PubChem CID54346225
Molecular FormulaC7H7NO2
Molecular Weight137.14 g/mol
Exact Mass137.05
IUPAC Name4-(nitrosomethyl)phenol
SMILESO=NCc1ccc(O)cc1
InChIInChI=1S/C7H7NO2/c9-7-3-1-6(2-4-7)5-8-10/h1-4,9H,5H2
InChIKeyUCMJYLGFDFZTDU-UHFFFAOYSA-N
XLogP1.66
TPSA49.66 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.14
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-4-(nitrosomethyl)phenol
CID 123274158
4-[(4-hydroxyphenyl)methyl]phenol
CID 12111
1,3-bis(4-hydroxyphenyl)propan-2-one
CID 159297209
N,N-bis[(4-hydroxyphenyl)methyl]formamide
CID 82254480
(4-hydroxyphenyl)methyl-oxophosphanium
CID 154446529
4-(phosphanylmethyl)phenol
CID 58879736
4-(hydroxymethyl)phenol;hydrate
CID 141133894
4-(iodomethyl)phenol
CID 11241787
N-(4-chlorophenyl)-N-[(4-hydroxyphenyl)methyl]nitrous amide
CID 165348877
4-methyl-1-[[4-(nitrosomethyl)phenyl]methyl]pyrazole
CID 134423680
sodium;hydride;(4-hydroxyphenyl)methyl formate
CID 173269022
ethane;4-ethylphenol;formaldehyde
CID 131698499

Frequently Asked Questions

What is the IUPAC name of 4-(nitrosomethyl)phenol?
The IUPAC name of 4-(nitrosomethyl)phenol (CID 54346225) is 4-(nitrosomethyl)phenol.
What is the SMILES notation for 4-(nitrosomethyl)phenol?
The canonical SMILES for 4-(nitrosomethyl)phenol is O=NCc1ccc(O)cc1.
What is the InChIKey of 4-(nitrosomethyl)phenol?
The InChIKey is UCMJYLGFDFZTDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7NO2/c9-7-3-1-6(2-4-7)5-8-10/h1-4,9H,5H2.
What are the key properties of 4-(nitrosomethyl)phenol?
4-(nitrosomethyl)phenol has a molecular weight of 137.14 g/mol, XLogP of 1.66, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(nitrosomethyl)phenol is sourced from PubChem (CID 54346225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).