(2E)-2-hydroxyimino-2-(2-phenylphenyl)acetonitrile

C14H10N2O — CID 134092476

IUPAC(2E)-2-hydroxyimino-2-(2-phenylphenyl)acetonitrile
SMILESN#C/C(=N/O)c1ccccc1-c1ccccc1
InChIInChI=1S/C14H10N2O/c15-10-14(16-17)13-9-5-4-8-12(13)11-6-2-1-3-7-11/h1-9,17H/b16-14-
InChIKeyGGOGVHWFMVYFGB-PEZBUJJGSA-N
MW222.25 g/mol
LogP3.06
Rot. Bonds2

About (2E)-2-hydroxyimino-2-(2-phenylphenyl)acetonitrile

(2E)-2-hydroxyimino-2-(2-phenylphenyl)acetonitrile (PubChem CID 134092476) has the molecular formula C14H10N2O and a molecular weight of 222.25 g/mol. Its IUPAC name is (2E)-2-hydroxyimino-2-(2-phenylphenyl)acetonitrile.

Molecular Properties

Compound Name(2E)-2-hydroxyimino-2-(2-phenylphenyl)acetonitrile
PubChem CID134092476
Molecular FormulaC14H10N2O
Molecular Weight222.25 g/mol
Exact Mass222.08
IUPAC Name(2E)-2-hydroxyimino-2-(2-phenylphenyl)acetonitrile
SMILESN#C/C(=N/O)c1ccccc1-c1ccccc1
InChIInChI=1S/C14H10N2O/c15-10-14(16-17)13-9-5-4-8-12(13)11-6-2-1-3-7-11/h1-9,17H/b16-14-
InChIKeyGGOGVHWFMVYFGB-PEZBUJJGSA-N
XLogP3.06
TPSA56.38 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2E)-2-hydroxyimino-2-(2-phenoxyphenyl)acetonitrile
CID 10933544
(NE)-N-[1-(2-phenylphenyl)propylidene]hydroxylamine
CID 164677574
2-hydroxyimino-2-phenylacetonitrile;methyl cyanate
CID 173433302
2-(4-cyanophenyl)benzoic acid
CID 2757952
1-buta-2,3-dien-2-yl-2-phenylbenzene
CID 177461787
[amino-(2-phenylphenyl)methylidene]azanium
CID 6346948
acetylene;2-phenylbenzoic acid
CID 67726329
(2-phenylphenyl)-pyrrol-1-ylmethanone
CID 166440403
1-(4-bromobuta-2,3-dien-2-yl)-2-phenylbenzene
CID 88812919
2-oxo-2-(2-phenylphenyl)acetyl chloride
CID 87185845
1-(1-azulen-1-ylethenyl)azulene
CID 21389906
2-phenyl-N'-(trifluoromethyl)benzenecarboximidamide
CID 118916827

Frequently Asked Questions

What is the IUPAC name of (2E)-2-hydroxyimino-2-(2-phenylphenyl)acetonitrile?
The IUPAC name of (2E)-2-hydroxyimino-2-(2-phenylphenyl)acetonitrile (CID 134092476) is (2E)-2-hydroxyimino-2-(2-phenylphenyl)acetonitrile.
What is the SMILES notation for (2E)-2-hydroxyimino-2-(2-phenylphenyl)acetonitrile?
The canonical SMILES for (2E)-2-hydroxyimino-2-(2-phenylphenyl)acetonitrile is N#C/C(=N/O)c1ccccc1-c1ccccc1.
What is the InChIKey of (2E)-2-hydroxyimino-2-(2-phenylphenyl)acetonitrile?
The InChIKey is GGOGVHWFMVYFGB-PEZBUJJGSA-N. The full InChI is InChI=1S/C14H10N2O/c15-10-14(16-17)13-9-5-4-8-12(13)11-6-2-1-3-7-11/h1-9,17H/b16-14-.
What are the key properties of (2E)-2-hydroxyimino-2-(2-phenylphenyl)acetonitrile?
(2E)-2-hydroxyimino-2-(2-phenylphenyl)acetonitrile has a molecular weight of 222.25 g/mol, XLogP of 3.06, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-2-hydroxyimino-2-(2-phenylphenyl)acetonitrile is sourced from PubChem (CID 134092476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).