Basic information
- CAS
85103-47-5- Standard SMILES
COc1ccc(/C=N/OCC(=O)O)cc1- InChIKey
SHNNDTPBBAXFPC-IZZDOVSWSA-N- Molecular formula
- C10H11NO4
- Average molar mass
- 209.2 g/mol
Names & identifiers
- Preferred name
- 2-({[(4-Methoxyphenyl)methylidene]amino}oxy)acetic acid
- IUPAC
- 2-[(E)-(4-methoxyphenyl)methylideneamino]oxyacetic acid
- English name
- ([[(1E)-(4-Methoxyphenyl)methylene]amino]oxy)acetic acid
- Molecular formula
- C10H11NO4
- Molecular weight
- 209.2
Names & synonyms
2-({[(4-methoxyphenyl)methylidene]amino}oxy)acetic acid98381-25-02-[(E)-(4-methoxyphenyl)methylideneamino]oxyacetic acid(E)-2-(((4-Methoxybenzylidene)amino)oxy)acetic acid({[(1E)-(4-methoxyphenyl)methylene]amino}oxy)acetic acidSTK214164AKOS000117023CS-0117690ST45101861EN300-07668(E)-2-(4-methoxybenzylideneaminooxy)acetic acidSR-01000027179
Show more names
AKOS BC-1575([[(1E)-(4-Methoxyphenyl)methylene]amino]oxy)acetic acidAcetic acid, [[[(4-methoxyphenyl)methylene]amino]oxy]-, (E)- (9CI)
SR-01000027179-1Z567747852-[(1E)-2-(4-methoxyphenyl)-1-azavinyloxy]acetic acid({[(E)-(4-methoxyphenyl)methylidene]amino}oxy)acetic acid2-({[(4-METHOXYPHENYL)METHYLENE]AMINO}OXY)ACETIC ACID
Database identifiers
- CAS
85103-47-5
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 68.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 221
Physicochemical properties
- Boiling point
- 368.2 · 368.2±52.0 °C(Predicted)
- Density
- 1.18 · 1.18±0.1 g/cm3(Predicted)
- pka
- 3.05 · 3.05±0.10(Predicted)
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hazard_code
- Xi
- hazard_class
- IRRITANT
Chemistry & industry
Suppliers9 total
Ryan Scientific, Inc.[email protected]
圣克鲁斯生物技术（上海）有限公司021-60936350 · [email protected]
爱必信（上海）生物科技有限公司021-38015121-8802 · [email protected]
MATRIX[email protected]
ENAMINE-CHI[email protected]
UKRORGSYN-BB[email protected]
宝欧信特生物科技（苏州）有限公司51288865780 · [email protected]
SIGMAALDRICH—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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