UCSF

ZINC00391809

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2005 14 Yes

Popular Name: 1-Naphthylacetic acid 1-Naphthylacetic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 15165-79-4 , 581-96-4 , 61-31-4 , 830-81-9 , 86-87-3 , [581-96-4] , [61-31-4] , [86-87-3]

Other Names:

(1-Naphthyl)acetic acid, BSI, ISO;1-NAA;1-Naphthaleneacetic acid;1-Naphthylacetic acid;2-(alpha-Naphthyl)ethanoic acid;Fruitone N;Naphthalene-1-acetic acid;Phyomone;Planofix;Tre-Hold

1-Naphthalene acetic acid

1-Naphthalene acetic acid; 1-Naphthaleneacetic acid; 1-Naphthtaleneacetic acid; 1-Naphthylacetic acid; 1-Naphthylessigsaeure; 2-(1-Naphthyl)acetic acid; 2-(alpha-Naphthyl)ethanoic aid; AI3-16113; ANU; Acide naphthylacetique [French]; Acide naphtylacetique

1-Naphthaleneacetic acid

1-NAPHTHALENEACETIC ACID POTASSIUM SALT

1-Naphthaleneacetic acid sodium salt

1-Naphthaleneacetic acid sodium salt; 61-31-4; C18534

1-Naphthaleneacetic Acid [86-87-3]; (NAA)

1-Naphthaleneacetic acid, sodium salt; 1-Naphthylacetic acid sodium salt; Caswell No. 589D; EINECS 200-504-2; EPA Pesticide Chemical Code 056007; LS-94368; Pomonit; Pomonit R 10; Radi-Stim; Sodium 1-naphthaleneacetate; Sodium 1-naphthylacetate; Sodium alp

1-naphthaleneacetic acid; NAA; alpha-NAA; alpha-naphthaleneacetic acid; naphthalene-1-acetic acid

1-NAPHTHALENEACETIC ACID; [86-87-3]

1-Naphthaleneaceticacid, potassium salt (1:1)

1-NaphthylAcetate

1-Naphthylacetic acid (JAN); 86-87-3; D01558; alpha-Naphthylacetic acid

1-Naphthylacetic acid, 95%

1-Naphthylacetic acid, 96%, may cont. up to 3% 2-isomer

1-Naphthylacetic acid, 96%, may cont. up to 4% 2-isomer

1-Naphthylacetic acid; 97%

2-(naphthalen-1-yl)acetic acid

2-Naphthylacetic acid

alpha-Naphthaleneacetic acid

CHEBI:44550; CHEBI:25473; CHEBI:31044

MFCD00004046

MFCD00004126

MFCD00064967

MFCD00067168

MFCD03938376

NA

NAA

Naphthalen-1-Yl-Acetic Acid

naphthalen-1-ylacetic acid

Naphthalene-1 acetic acid

Naphthalene-1-acetic acid

NAPHTHYLACETICACID 1-

PotassiuM 1-Naphthaleneacetate

potassium1-naphthaleneacetate

SodiuM 1-Naphthaleneacetate

Sodium 1-naphthaleneacetic acid

Sodium 2-(naphthalen-1-yl)acetate

Store at 2-8°C

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) 2.52 7.96 -49.58 0 2 -1 40 185.202 2 ↓

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 1.10e-01 g/l DrugBank-experimental
Mp [°C] 126 - 133 Acros Organics
Melting_Point 126-133? Alfa-Aesar
Melting_Point 126-133° Alfa-Aesar
MP 132 TCI
M.P 141-143 °C Indofine
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
UniProt Database Links AB4B_ARATH; ACY2_BOVIN; ACY2_DANRE; ACY2_HUMAN; ACY2_MACFA; ACY2_MOUSE; ACY2_PIG; ACY2_PONAB; ACY2_RAT; ACY2_XENTR; ARGOS_BRARP; ARGOS_ORYSJ; CGT_FRAAN; GH317_ARATH; GH32_ARATH; GH33_ARATH; GH34_ARATH; GH35_ARATH; GH36_ARATH; HYPC_ASPFN; NAT8L_DANRE; NAT8 ChEBI
SOLUBILITY acetone: 50 mg/mL, clear Indofine
Patent Database Links EP1621566; US2002115570; US2007264241 ChEBI
H phrase H302: Harmful if swallowed Acros Organics
Warnings IRRITANT Matrix Scientific
P phrase P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell Acros Organics
Notes Plant culture tested Apollo Scientific Bioactives
R phrase R22: Harmful if swallowed. Acros Organics
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics
Hazard XN: Harmful Acros Organics

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