phenyl-[2-(trideuteriomethoxy)phenyl]methanol

C14H14O2 — CID 101015641

IUPACphenyl-[2-(trideuteriomethoxy)phenyl]methanol
SMILES[2H]C([2H])([2H])Oc1ccccc1C(O)c1ccccc1
InChIInChI=1S/C14H14O2/c1-16-13-10-6-5-9-12(13)14(15)11-7-3-2-4-8-11/h2-10,14-15H,1H3/i1D3
InChIKeyFYFYNXNAKOEXDV-FIBGUPNXSA-N
MW217.28 g/mol
LogP2.78
Rot. Bonds4

About phenyl-[2-(trideuteriomethoxy)phenyl]methanol

phenyl-[2-(trideuteriomethoxy)phenyl]methanol (PubChem CID 101015641) has the molecular formula C14H14O2 and a molecular weight of 217.28 g/mol. Its IUPAC name is phenyl-[2-(trideuteriomethoxy)phenyl]methanol.

Molecular Properties

Compound Namephenyl-[2-(trideuteriomethoxy)phenyl]methanol
PubChem CID101015641
Molecular FormulaC14H14O2
Molecular Weight217.28 g/mol
Exact Mass217.12
IUPAC Namephenyl-[2-(trideuteriomethoxy)phenyl]methanol
SMILES[2H]C([2H])([2H])Oc1ccccc1C(O)c1ccccc1
InChIInChI=1S/C14H14O2/c1-16-13-10-6-5-9-12(13)14(15)11-7-3-2-4-8-11/h2-10,14-15H,1H3/i1D3
InChIKeyFYFYNXNAKOEXDV-FIBGUPNXSA-N
XLogP2.78
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(R)-[2-[(S)-hydroxy(phenyl)methyl]phenyl]-phenylmethanol
CID 92542463
phenyl-[2-(trifluoromethoxy)phenyl]methanol
CID 62789776
(4-iodophenyl)-(2-methoxyphenyl)methanol
CID 114978781
[4-(difluoromethyl)phenyl]-(2-methoxyphenyl)methanol
CID 115525064
(R)-(2-methoxyphenyl)-thiophen-3-ylmethanol
CID 93312294
[2-[hydroxy(phenyl)methyl]phenyl] N,N-di(propan-2-yl)carbamate
CID 15423381
3-[hydroxy-(2-methoxyphenyl)methyl]benzonitrile
CID 115481118
(5-tert-butyl-2-methoxyphenyl)-phenylmethanol
CID 171366960
(2-tert-butylphenyl)-phenylmethanol
CID 19438357
(2-ethoxyphenyl)-(3-methoxyphenyl)methanol
CID 62801888
[2-[2-[hydroxy(phenyl)methyl]-N-[2-[hydroxy(phenyl)methyl]phenyl]anilino]phenyl]-phenylmethanol
CID 132774417
[2-[hydroxy(oxido)amino]-4,5-dimethoxyphenyl]-phenylmethanol
CID 163131632

Frequently Asked Questions

What is the IUPAC name of phenyl-[2-(trideuteriomethoxy)phenyl]methanol?
The IUPAC name of phenyl-[2-(trideuteriomethoxy)phenyl]methanol (CID 101015641) is phenyl-[2-(trideuteriomethoxy)phenyl]methanol.
What is the SMILES notation for phenyl-[2-(trideuteriomethoxy)phenyl]methanol?
The canonical SMILES for phenyl-[2-(trideuteriomethoxy)phenyl]methanol is [2H]C([2H])([2H])Oc1ccccc1C(O)c1ccccc1.
What is the InChIKey of phenyl-[2-(trideuteriomethoxy)phenyl]methanol?
The InChIKey is FYFYNXNAKOEXDV-FIBGUPNXSA-N. The full InChI is InChI=1S/C14H14O2/c1-16-13-10-6-5-9-12(13)14(15)11-7-3-2-4-8-11/h2-10,14-15H,1H3/i1D3.
What are the key properties of phenyl-[2-(trideuteriomethoxy)phenyl]methanol?
phenyl-[2-(trideuteriomethoxy)phenyl]methanol has a molecular weight of 217.28 g/mol, XLogP of 2.78, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-[2-(trideuteriomethoxy)phenyl]methanol is sourced from PubChem (CID 101015641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).