UCSF

ZINC00065317

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 14 Yes

Popular Name: 2-Naphthaleneacetic acid 2-Naphthaleneacetic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1523-11-1 , 581-96-4 , [581-96-4]

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.55 1.15 -49.27 0 2 -1 40 185.202 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 139-142° Oakwood Chemical
MP 141 - 143 Enamine Building Blocks
Melting_Point 141-143? Alfa-Aesar
Melting_Point 141-143° Alfa-Aesar
MP 141...143 Enamine Building Blocks
MP 142 TCI
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 98% Fluorochem
Warnings IRRITANT Matrix Scientific
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics
Patent Database Links US2003077595; US2008009613; WO2007117394 ChEBI

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )