carbamic acid;4-fluorophenol

C7H8FNO3 — CID 67037635

IUPACcarbamic acid;4-fluorophenol
SMILESNC(=O)O.Oc1ccc(F)cc1
InChIInChI=1S/C6H5FO.CH3NO2/c7-5-1-3-6(8)4-2-5;2-1(3)4/h1-4,8H;2H2,(H,3,4)
InChIKeyKEKXYCWVAFFEKY-UHFFFAOYSA-N
MW173.14 g/mol
LogP1.15
Rot. Bonds

About carbamic acid;4-fluorophenol

carbamic acid;4-fluorophenol (PubChem CID 67037635) has the molecular formula C7H8FNO3 and a molecular weight of 173.14 g/mol. Its IUPAC name is carbamic acid;4-fluorophenol.

Molecular Properties

Compound Namecarbamic acid;4-fluorophenol
PubChem CID67037635
Molecular FormulaC7H8FNO3
Molecular Weight173.14 g/mol
Exact Mass173.05
IUPAC Namecarbamic acid;4-fluorophenol
SMILESNC(=O)O.Oc1ccc(F)cc1
InChIInChI=1S/C6H5FO.CH3NO2/c7-5-1-3-6(8)4-2-5;2-1(3)4/h1-4,8H;2H2,(H,3,4)
InChIKeyKEKXYCWVAFFEKY-UHFFFAOYSA-N
XLogP1.15
TPSA83.55 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.14
LogP ≤ 51.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

benzene-1,4-diol;carbamic acid
CID 158152403
4-fluorophenol;zirconium
CID 74015831
4-fluorophenol;dihydrofluoride
CID 174753793
4-fluorophenol;hydroxylamine;molecular hydrogen
CID 153362949
bis(benzene-1,4-diol);carbonic acid
CID 68999082
benzene-1,4-diol;bis(carbonochloridic acid)
CID 88626598
oxamide;phenol
CID 21277500
4-[bis(4-aminophenyl)-(4-fluorophenyl)methyl]aniline;4-[(4-fluorophenyl)-bis(4-hydroxyphenyl)methyl]phenol
CID 161324923
(E)-but-2-enedioic acid;4-fluorobenzamide
CID 69010186
bis(cyclopenta-1,3-diene);bis(4-fluorophenol);zirconium(2+)
CID 141004832
acetamide;4-hydroxybenzoic acid
CID 67150268
chloromethane;4-fluorobenzamide
CID 158476805

Frequently Asked Questions

What is the IUPAC name of carbamic acid;4-fluorophenol?
The IUPAC name of carbamic acid;4-fluorophenol (CID 67037635) is carbamic acid;4-fluorophenol.
What is the SMILES notation for carbamic acid;4-fluorophenol?
The canonical SMILES for carbamic acid;4-fluorophenol is NC(=O)O.Oc1ccc(F)cc1.
What is the InChIKey of carbamic acid;4-fluorophenol?
The InChIKey is KEKXYCWVAFFEKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5FO.CH3NO2/c7-5-1-3-6(8)4-2-5;2-1(3)4/h1-4,8H;2H2,(H,3,4).
What are the key properties of carbamic acid;4-fluorophenol?
carbamic acid;4-fluorophenol has a molecular weight of 173.14 g/mol, XLogP of 1.15, 0 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbamic acid;4-fluorophenol is sourced from PubChem (CID 67037635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).