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Details

Stereochemistry ACHIRAL
Molecular Formula C11H13O.Na
Molecular Weight 184.2101
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Cyclopentylphenol sodium

SMILES

[Na+].[O-]C1=C(C=CC=C1)C2CCCC2

InChI

InChIKey=DBKFXYPXWFYEEZ-UHFFFAOYSA-M
InChI=1S/C11H14O.Na/c12-11-8-4-3-7-10(11)9-5-1-2-6-9;/h3-4,7-9,12H,1-2,5-6H2;/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C11H13O
Molecular Weight 161.2203
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:23:05 GMT 2023
Edited
by admin
on Sat Dec 16 19:23:05 GMT 2023
Record UNII
YKY37J2U7C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Cyclopentylphenol sodium
Systematic Name English
Phenol, 2-cyclopentyl-, sodium salt
Common Name English
Phenol, 2-cyclopentyl-, sodium salt (1:1)
Common Name English
Code System Code Type Description
CAS
199454-01-8
Created by admin on Sat Dec 16 19:23:06 GMT 2023 , Edited by admin on Sat Dec 16 19:23:06 GMT 2023
PRIMARY
PUBCHEM
157755267
Created by admin on Sat Dec 16 19:23:06 GMT 2023 , Edited by admin on Sat Dec 16 19:23:06 GMT 2023
PRIMARY
FDA UNII
YKY37J2U7C
Created by admin on Sat Dec 16 19:23:06 GMT 2023 , Edited by admin on Sat Dec 16 19:23:06 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE