Acetic acid, 2-[(3,5,6-trichloro-2-pyridinyl)oxy]-, methyl ester

HCID 94596
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Basic information

CAS
60825-26-5
Standard SMILES
COC(=O)COc1nc(Cl)c(Cl)cc1Cl
InChIKey
MNYBZEHWPRTNJY-UHFFFAOYSA-N
Molecular formula
C8H6Cl3NO3
Average molar mass
270.5 g/mol
Monoisotopic mass
268.94132609

Names & identifiers

Preferred name
Acetic acid, 2-[(3,5,6-trichloro-2-pyridinyl)oxy]-, methyl ester
IUPAC
methyl 2-[(3,5,6-trichloro-2-pyridinyl)oxy]acetate
English name
Triclopyr methyl estersuffix added to CAS to differentiate from non-deuterated/derivatized compound.
Molecular formula
C8H6Cl3NO3
Molecular weight
270.5

Names & synonyms

Acetic acid, [(3,5,6-trichloro-2-pyridinyl)oxy]-, methyl ester((3,5,6-Trichloro-2-pyridyl)oxy)acetic acid, methyl esterAcetic acid, ((3,5,6-trichloro-2-pyridinyl)oxy)-, methyl esterAcetic acid, 2-((3,5,6-trichloro-2-pyridinyl)oxy)-, methyl esterAcetic acid, 2-[(3,5,6-trichloro-2-pyridinyl)oxy]-, methyl esterRefChem:55206660825-26-5Triclopyr methyl esterTriclopyr-methylmethyl 2-(3,5,6-trichloropyridin-2-yl)oxyacetateMETHYL 2-[(3,5,6-TRICHLOROPYRIDIN-2-YL)OXY]ACETATEMethyl 2-[(3,5,6-trichloro-2-pyridinyl)oxy]acetate
Show more names
Chlorpyrifos Impurity 56C17800600 Triclopyr-methylTriclopyr Methyl Ester @100 μg/mL in MeOHMethyl [(3,5,6-trichloro-2-pyridinyl)oxy]acetate-biphenyl]-2-yl-,1-(phenylmethyl)-4-piperidinylester[(3,5,6-Trichloropyridin-2-yl)oxy]acetic acid methyl esterTriclopyr methyl estersuffix added to CAS to differentiate from non-deuterated/derivatized compound.
SCHEMBL3232675DTXSID8069432SCHEMBL31438450NS00001510methyl 3,5,6-trichloro-2-pyridinyloxyacetateMethyl [(3,5,6-trichloropyridin-2-yl)oxy]acetate3,5,6-trichloro-2-pyridoxyacetic acid, methyl esterMethyl [(3,5,6-trichloro-2-pyridinyl)oxy]acetate #

Database identifiers

CAS
60825-26-5
PubChem CID
94596
DTXSID
DTXSID8069432
Nikkaji
J313.196C

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
48.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
15

Physicochemical properties

Boiling point
313.3 · 313.3±37.0 °C(predicted)
Density
1.511 · 1.511±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)
pka
-3.32 · -3.32±0.10(predicted)
Henry's Law Constant
6 · 6.0×100 mol/(m3Pa) at 25℃, Zhang et al. (2010)
EPA Substance Registry System
Acetic acid, [(3,5,6-trichloro-2-pyridinyl)oxy]-, methyl ester (60825-26-5)
TSCA
TSCA listed

Safety & regulation

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationAcetic acid, 2-[(3,5,6-trichloro-2-pyridinyl)oxy]-, methyl ester: INACTIVE

Suppliers13 total

梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
广东云星生物技术有限公司0751-18902340975/189023400307 18902340307 · [email protected]
上海柯维化学技术有限公司021-64609169 18901607656 · [email protected]
杭州宇昊化工科技有限公司0571-82693216 · [email protected]
天津阿尔塔科技有限公司022-6537-8550 15522853686 · [email protected]

Related reactions

3 records
New reaction record

Compound notes

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