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Home> Hot Product Listed 2   > 2-chloro-n-cyclohexyl-n-(1,1-dioxothiolan-3-yl)acetamide
51-67-2 structure

2-chloro-n-cyclohexyl-n-(1,1-dioxothiolan-3-yl)acetamide

Iupac Name:4-(2-aminoethyl)phenol
CAS No.:51-67-2
Molecular Weight:137.182
Molecular Formula:C12H15N3O2S (isomer)
Names and Identifiers
Synonyms

2-chloro-n-cyclohexyl-n-(1,1-dioxidotetrahydrothien-3-yl)acetamide 2-chloro-n-cyclohexyl-n-(1,1-dioxidotetrahydrothiophen-3-yl)acetamide 2-chloro-n-cyclohexyl-n-(1,1-dioxo-1??-thiolan-3-yl)acetamide 2-chloro-n-cyclohexyl-n-(1,1-dioxo-1lambda-thiolan-3-yl)acetamide AC1MSA0U AC1Q3TC4 AKOS000117682 AKOS016039825 BG00628080 EN300-09221 MCULE-2701214736 MOLPORT-000-394-204 n-(1,1-dioxothiolan-3-yl)-2-chloro-n-cyclohexylacetamide NE41277 SBB041593 sr-01000051102 SR-01000051102-1 STL454850

Inchi
InChI=1S/C8H11NO/c9-6-5-7-1-3-8(10)4-2-7/h1-4,10H,5-6,9H2
InChkey
DZGWFCGJZKJUFP-UHFFFAOYSA-N
Canonical Smiles
C1=CC(=CC=C1CCN)O
Properties
Melting Point
155-163℃
Safety and Handling
Risk Statements
R36/37/38
Safety Statements
S26;S37/39
Transport
25kgs
Reach Info
This substance has been officially registered by enterprises.
ECHA (EU chemicals Management Agency) published the completed registration file as follows:
Completed registration file:
Registered as ubmitted Total tonnage band  
FULL JOINT 0_10 view >
INTERMEDIATE JOINT INTERMEDIATE_USE_ONLY view >
Registered companies:
Registrant / Supplier details Latest dossier received
OLON Spa 2016
more >
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Not classified.

2.2 GHS label elements, including precautionary statements

Pictogram(s) No symbol.
Signal word

No signal word.

Hazard statement(s)

none

Precautionary statement(s)
Prevention

none

Response

none

Storage

none

Disposal

none

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:137.182g/mol
  • Molecular Formula:C12H15N3O2S
  • Compound Is Canonicalized:True
  • XLogP3-AA:1.1
  • Exact Mass:137.084
  • Monoisotopic Mass:137.084
  • Complexity:87.3
  • Rotatable Bond Count:2
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:2
  • Topological Polar Surface Area:46.2A^2
  • Heavy Atom Count:10
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADccByIAAAAAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAHgAQCAAADATBmAQwBoBAAgCA AiBCAAACAAAgIAAIiIAGCIgIJiKCkROAcAAk0BEImAeQwIAOIAAAAAAAAABAAAAAAAAAAAAAAAAA AA==
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Recommended Suppliers
  • Tel:86-571-88938639
  • Fax:86-571-88938652
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  • Fax:86-571-85829153
  • Tel:0086-27-59207850
  • Fax:0086-27-59524646
  • Tel:+86-0592-5567629
  • Fax:+86-0592-5567629
  • Tel:86-371-86658258
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  • Tel:86-25-83697070
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  • Tel:86-571-87396430
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  • Tel:86-571-86960370
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