acetic acid;biphenylen-2-ol

C14H12O3 — CID 71351696

IUPACacetic acid;biphenylen-2-ol
SMILESCC(=O)O.Oc1ccc2c(c1)-c1ccccc1-2
InChIInChI=1S/C12H8O.C2H4O2/c13-8-5-6-11-9-3-1-2-4-10(9)12(11)7-8;1-2(3)4/h1-7,13H;1H3,(H,3,4)
InChIKeyICHCWEHYFCERLC-UHFFFAOYSA-N
MW228.25 g/mol
LogP3.13
Rot. Bonds

About acetic acid;biphenylen-2-ol

acetic acid;biphenylen-2-ol (PubChem CID 71351696) has the molecular formula C14H12O3 and a molecular weight of 228.25 g/mol. Its IUPAC name is acetic acid;biphenylen-2-ol.

Molecular Properties

Compound Nameacetic acid;biphenylen-2-ol
PubChem CID71351696
Molecular FormulaC14H12O3
Molecular Weight228.25 g/mol
Exact Mass228.08
IUPAC Nameacetic acid;biphenylen-2-ol
SMILESCC(=O)O.Oc1ccc2c(c1)-c1ccccc1-2
InChIInChI=1S/C12H8O.C2H4O2/c13-8-5-6-11-9-3-1-2-4-10(9)12(11)7-8;1-2(3)4/h1-7,13H;1H3,(H,3,4)
InChIKeyICHCWEHYFCERLC-UHFFFAOYSA-N
XLogP3.13
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

acetic acid;phenol
CID 70537927
2-hydroxyanthracene-9,10-dione
CID 11796
biphenylene;propan-2-one
CID 174440223
[2-[5-hydroxy-2-(4-hydroxyphenyl)phenyl]phenyl]-phenylmethanone
CID 141056080
3,4-diphenylphenol;sulfane
CID 172728711
biphenylene;2-methylprop-2-enoic acid
CID 174864090
acetic acid;benzene-1,3,5-triol
CID 53443381
biphenylene-2-carboxylic acid;hydrochloride
CID 70419826
N-(3-acetamidoazulen-1-yl)acetamide
CID 86151929
2-[4-(2-carboxy-5-hydroxyphenyl)-3-phenylphenyl]-4-hydroxybenzoic acid
CID 69497360
6,10-dihydroxy-10H-phenanthren-9-one
CID 156704624
phenol;propan-2-one;hydrate
CID 161159865

Frequently Asked Questions

What is the IUPAC name of acetic acid;biphenylen-2-ol?
The IUPAC name of acetic acid;biphenylen-2-ol (CID 71351696) is acetic acid;biphenylen-2-ol.
What is the SMILES notation for acetic acid;biphenylen-2-ol?
The canonical SMILES for acetic acid;biphenylen-2-ol is CC(=O)O.Oc1ccc2c(c1)-c1ccccc1-2.
What is the InChIKey of acetic acid;biphenylen-2-ol?
The InChIKey is ICHCWEHYFCERLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8O.C2H4O2/c13-8-5-6-11-9-3-1-2-4-10(9)12(11)7-8;1-2(3)4/h1-7,13H;1H3,(H,3,4).
What are the key properties of acetic acid;biphenylen-2-ol?
acetic acid;biphenylen-2-ol has a molecular weight of 228.25 g/mol, XLogP of 3.13, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for acetic acid;biphenylen-2-ol is sourced from PubChem (CID 71351696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).