(2R)-1,1-bis(4-methoxyphenyl)propan-2-ol

C17H20O3 — CID 91746525

IUPAC(2R)-1,1-bis(4-methoxyphenyl)propan-2-ol
SMILESCOc1ccc(C(c2ccc(OC)cc2)[C@@H](C)O)cc1
InChIInChI=1S/C17H20O3/c1-12(18)17(13-4-8-15(19-2)9-5-13)14-6-10-16(20-3)11-7-14/h4-12,17-18H,1-3H3/t12-/m1/s1
InChIKeyNHUSVJTYMHDUAP-GFCCVEGCSA-N
MW272.34 g/mol
LogP3.22
Rot. Bonds5

About (2R)-1,1-bis(4-methoxyphenyl)propan-2-ol

(2R)-1,1-bis(4-methoxyphenyl)propan-2-ol (PubChem CID 91746525) has the molecular formula C17H20O3 and a molecular weight of 272.34 g/mol. Its IUPAC name is (2R)-1,1-bis(4-methoxyphenyl)propan-2-ol.

Molecular Properties

Compound Name(2R)-1,1-bis(4-methoxyphenyl)propan-2-ol
PubChem CID91746525
Molecular FormulaC17H20O3
Molecular Weight272.34 g/mol
Exact Mass272.14
IUPAC Name(2R)-1,1-bis(4-methoxyphenyl)propan-2-ol
SMILESCOc1ccc(C(c2ccc(OC)cc2)[C@@H](C)O)cc1
InChIInChI=1S/C17H20O3/c1-12(18)17(13-4-8-15(19-2)9-5-13)14-6-10-16(20-3)11-7-14/h4-12,17-18H,1-3H3/t12-/m1/s1
InChIKeyNHUSVJTYMHDUAP-GFCCVEGCSA-N
XLogP3.22
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.34
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S,3R)-3-(4-methoxyphenyl)butan-2-ol
CID 13481815
CID 175713586
CID 175713586
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(1S)-1-[4-(4-methoxyphenoxy)phenyl]ethanol
CID 63372514
3-(4-methoxyphenyl)heptane-2,4-diol
CID 21414884
chloro-(4-methoxyphenyl)methanol
CID 130923369
2-chloro-1-(4-methoxyphenyl)ethanol
CID 12862876
1-(1-iodoethyl)-4-methoxybenzene;1-(4-methoxyphenyl)ethanol
CID 158169844
(2R,3S)-4,4-bis(4-methoxyphenyl)-2,3-dimethylbutan-1-ol
CID 53474824
(4-methoxyphenyl)methanediol;titanium;bis(titanium(3+));dihydrate
CID 139244940
O-[4-[1,2-bis(4-aminooxyphenyl)-2-(4-methoxyphenyl)ethyl]phenyl]hydroxylamine
CID 161215163
(1R,3S)-1-(4-methoxyphenyl)butane-1,3-diol
CID 101493823

Frequently Asked Questions

What is the IUPAC name of (2R)-1,1-bis(4-methoxyphenyl)propan-2-ol?
The IUPAC name of (2R)-1,1-bis(4-methoxyphenyl)propan-2-ol (CID 91746525) is (2R)-1,1-bis(4-methoxyphenyl)propan-2-ol.
What is the SMILES notation for (2R)-1,1-bis(4-methoxyphenyl)propan-2-ol?
The canonical SMILES for (2R)-1,1-bis(4-methoxyphenyl)propan-2-ol is COc1ccc(C(c2ccc(OC)cc2)[C@@H](C)O)cc1.
What is the InChIKey of (2R)-1,1-bis(4-methoxyphenyl)propan-2-ol?
The InChIKey is NHUSVJTYMHDUAP-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H20O3/c1-12(18)17(13-4-8-15(19-2)9-5-13)14-6-10-16(20-3)11-7-14/h4-12,17-18H,1-3H3/t12-/m1/s1.
What are the key properties of (2R)-1,1-bis(4-methoxyphenyl)propan-2-ol?
(2R)-1,1-bis(4-methoxyphenyl)propan-2-ol has a molecular weight of 272.34 g/mol, XLogP of 3.22, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1,1-bis(4-methoxyphenyl)propan-2-ol is sourced from PubChem (CID 91746525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).