UCSF

ZINC04051722

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2005 10 Yes

Popular Name: 2,3-Dihydrobenzofuran-5-amine 2,3-Dihydrobenzofuran-5-amine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1093403-66-7 , 42933-43-7 , [1093403-66-7] , [42933-43-7]

Download: MOL2 SDF SMILES Flexibase

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) 1.04 -1.57 -5.07 2 2 0 35 135.166 0 ↓

Vendor Notes

Note Type Comments Provided By
MP 280 - 282 Enamine Building Blocks
MP 280...282 Enamine Building Blocks
MP 71 - 73 Enamine Building Blocks
MP 71...73 Enamine Building Blocks
Melting_Point 78-80? Alfa-Aesar
Melting_Point 78-80° Alfa-Aesar
Mp [°C] 81.6 - 83.4 Acros Organics
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
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 P280: Wear protective gloves/eye protection/face protection Acros Organics
P phrase P280: Wear protective gloves/eye protection/face protection; P302 + P352: IF ON SKIN: Wash with plenty of soap and water; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Co Acros Organics
R phrase R22: Harmful if swallowed. Acros Organics
R phrase R22: Harmful if swallowed.; R36/37/38: Irritating to eyes, respiratory system and skin. Acros Organics
S phrase S22: Do not breathe dust. Acros Organics
S phrase S22: Do not breathe dust.; S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S36/37/39: Wear suitable protective clothing, gloves and eye/face protection. Acros Organics
Hazard XN: Harmful Acros Organics

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