UCSF

ZINC00001080

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 13 Yes

Popular Name: Butylated hydroxyanisole Butylated hydroxyanisole

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CAS Numbers: 121-00-6 , 25013-16-5 , [121-00-6] , [25013-16-5]

Other Names:

(1,1-dimethylethyl)-4-methoxy-Phenol;(1,1-Dimethylethyl)-4-methoxyphenol, 9CI;2(3)-Tert-Butyl-4-hydroxyanisole;2-(1,1-Dimethylethyl)-4-methoxy-Phenol;2-(1,1-Dimethylethyl)-4-methoxy-phenol;2-Butyl-4-hydroxyanisole;2-Tert-butyl-4-methoxy-Phenol;2-Tert-Buty

(1,1-Dimethylethyl)-4-methoxyphenol; 2(3)-tert-Butyl-4-hydroxyanisole; 2-(1,1-dimethylethyl)-4-(methyloxy)phenol; 2-terc.Butyl-4-methoxyfenol [Czech]; 2-tert-butyl-4-methoxyphenol; 3-tert-Butyl-4-hydroxyanisole; AMIF-72; Anisole, butylated hydroxy-; Antra

2(3)-t-Butyl-4-hydroxyanisole

2(3)-tert-Butyl-4-hydroxyanisole; 2-(1,1-Dimethylethyl)-4-methoxy-phenol; 2-Butyl-4-hydroxyanisole; 2-tert-Butyl-4-methoxyphenol; 3-BHA; 3-Tert-butyl-4-hydroxyanisole; 3-t-Butyl-4-hydroxyanisole; 4-Methoxy-2-tert-butylphenol; BRN 1867499; Butylated hydrox

2(3)-tert-Butyl-4-methoxyphenol

2(3)-tert-Butyl-4-methoxyphenol, 96%

2-(1,1-dimethylethyl)-4-methoxyphenol; 3-(1,1-dimethylethyl)-4-hydroxyanisole; 3-BHA; 3-tert-butyl-p-hydroxyanisole; 4-hydroxy-3-tert-butylanisole; 4-methoxy-2-tert-butylphenol; 4-methoxy-6-tert-butylphenol; o-tert-butyl-p-methoxyphenol; p-methoxy-o-tert-

2-(tert-Butyl)-4-methoxyphenol

2-tert-butyl-4-methoxyphenol

2-tert-Butyl-4-methoxyphenol;Butylated hydroxyanisole

3-Tert-butyl-4-hydroxyanisole

3-tert-Butyl-4-hydroxyanisole, 98%

3-tert-Butyl-4-hydroxyanisole, 99%+

4-Hydroxy-3-tert-butylanisole

BHA

Butylated Hydroxyanisole (BAN

Butylhydroxyanisole

LS-104170

MFCD00040484

MFCD01779059

NF)

phenol, 2-(1,1-dimethylethyl)-4-methoxy-

Download: MOL2 SDF SMILES Flexibase

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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) 3.62 3.71 -4.23 1 2 0 29 180.247 2 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 55-65? Alfa-Aesar
Melting_Point 55-65° Alfa-Aesar
MP 60 TCI
MP 61 - 63 Enamine Building Blocks
Mp [°C] 61 - 64 Acros Organics
MP 61...63 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Therapy antioxidant SMDC Pharmakon
H phrase H302: Harmful if swallowed Acros Organics
H phrase H302: Harmful if swallowed; H315: Causes skin irritation; H319: Causes serious eye irritation; H335: May cause respiratory irritation Acros Organics
P phrase P261: Avoid breathing dust/fume/gas/mist/vapors/spray Acros Organics
P phrase P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P302 + P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minute Acros Organics

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