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Profoxydim

Profoxydim structure

CAS No:
139001-49-3
Formula:
C24H32ClNO4S
Chemical Name:
Profoxydim
Synonyms:
2-Cyclohexen-1-one,2-[1-[[2-(4-chlorophenoxy)propoxy]imino]butyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)-;2H-Thiopyran,2-cyclohexen-1-one deriv.;2-[1-[[2-(4-Chlorophenoxy)propoxy]imino]butyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)-2-cyclohexen-1-one;BAS 625H;Aura;Tetris;Profoxydim;BAS 625;Clefoxydim;Aura Plus;2-[1-[2-(4-Chlorophenoxy)propoxyimino]butyl]-3-hydroxy-5-thian-3-ylcyclohex-2-enone;211496-02-5
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Profoxydim Basic Attributes

Molecular Weight：

466.03300

Exact Mass：

466.03

EC Number：

604-105-8

DSSTox ID：

DTXSID5057969

Characteristics

PSA：

93.42000

XLogP3：

6.21440

Density：

1.217g/cm3

Melting Point：

<25 °C

Boiling Point：

592.2ºC at 760mmHg

Flash Point：

312ºC

Refractive Index：

1.596

Vapor Pressure：

0mmHg at 25°C

Safety Information

GHS Classification：

|Warning|H317: May cause an allergic skin reaction [Warning Sensitization, Skin]|P201, P202, P261, P272, P280, P281, P302+P352, P308+P313, P321, P333+P313, P363, P405, and P501|H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]|Aggregated GHS information provided by 243 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

profoxydim

Computed Properties

Molecular Weight:472.0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:471.1822358
Monoisotopic Mass:471.1822358
Topological Polar Surface Area:96.2
Heavy Atom Count:32
Complexity:666
Undefined Atom Stereocenter Count:3
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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CAS No.: 139001-49-3

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CAS No.: 139001-49-3

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