Structure

(S)-(-)-1,1'-Bi-2-naphthol

CAS
18531-99-2
Catalog Number
ACM18531992
Category
Organic Phosphine Compounds
Molecular Weight
286.33g/mol
Molecular Formula
C20H14O2;

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Specification

Synonyms
-binaphthyl; (+)-2,2'-Dihydroxy-1,1'-dinaphthyl; (+)-Bi-2-naphthol; [1,1']-binaphthalenyl-2,2'-diol; [1,1'-Binaphthalene]-2,2'-diol, (1S)-; DB-002116; SC-01966; (-)-2,2 inverted exclamation marka-Dihydroxy-1,1 inverted exclamation marka-dinaphthyl; PubChem14767; HOC10H6C10H6OH;
IUPAC Name
1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;
Canonical SMILES
C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)O)O;
InChI
InChI=1S/C20H14O2/c21-17-11-9-13-5-1-3-7-15(13)19(17)20-16-8-4-2-6-14(16)10-12-18(20)22/h1-12,21-22H;
InChI Key
PPTXVXKCQZKFBN-UHFFFAOYSA-N;
Melting Point
215.5°C;
Application
Chiral ligand.
Storage
2-8°C
Complexity
346
Covalently-Bonded Unit Count
1
EC Number
606-050-5
Exact Mass
286.099g/mol
H-Bond Acceptor
2
H-Bond Donor
2
Heavy Atom Count
22
Monoisotopic Mass
286.099g/mol
NSC Number
27049
Rotatable Bond Count
1
Topological Polar Surface Area
40.5A^2
UNII
M6IDZ128WT
What is the molecular formula of (S)-(-)-1,1'-Bi-2-naphthol?

The molecular formula is C20H14O2.

What is the molecular weight of (S)-(-)-1,1'-Bi-2-naphthol?

The molecular weight is 286.3 g/mol.

What is the IUPAC name of (S)-(-)-1,1'-Bi-2-naphthol?

The IUPAC name is 1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol.

What is the Canonical SMILES of (S)-(-)-1,1'-Bi-2-naphthol?

The Canonical SMILES is C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)O)O.

What is the InChI of (S)-(-)-1,1'-Bi-2-naphthol?

The InChI is InChI=1S/C20H14O2/c21-17-11-9-13-5-1-3-7-15(13)19(17)20-16-8-4-2-6-14(16)10-12-18(20)22/h1-12,21-22H.

What are the synonyms of (S)-(-)-1,1'-Bi-2-naphthol?

The synonyms include 18531-94-7, 602-09-5, and 18531-99-2.

What is the CAS number of (S)-(-)-1,1'-Bi-2-naphthol?

The CAS number is 602-09-5.

What is the ChEMBL ID of (S)-(-)-1,1'-Bi-2-naphthol?

The ChEMBL ID is CHEMBL138718.

What is the hydrogen bond donor count of (S)-(-)-1,1'-Bi-2-naphthol?

The hydrogen bond donor count is 2.

What is the XLogP3-AA value of (S)-(-)-1,1'-Bi-2-naphthol?

The XLogP3-AA value is 5.3.

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