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Home> Encyclopedia > Hot Product Listed O   > Octadecanoic-1-14C acid, methyl ester
3063-07-8 structure

Octadecanoic-1-14C acid, methyl ester

CAS No.:3063-07-8
Molecular Weight:257.20168
Molecular Formula:C12H7N3O4 (isomer)
Names and Identifiers
Synonyms

1,6-Dinitro-9H-carbazole 1,6-Dinitrocarbazole 1,6-Dinitro-carbazole 7CF4AD58B24E5617B4D836DAE3CBD1CD AC1LDLQE AKOS000631678 Ambcb5237099 BAS 00340402 CBDivE_013559 CCRIS 6771 LS-188300 MEFATMTVUAOEJH-UHFFFAOYSA-N MolPort-001-925-755 Oprea1_664715 Oprea1_767912 ZINC02968278

Inchi
InChI=1S/C12H7N3O4/c16-14(17)7-4-5-10-9(6-7)8-2-1-3-11(15(18)19)12(8)13-10/h1-6,13H
InChkey
MEFATMTVUAOEJH-UHFFFAOYSA-N
Canonical Smiles
C1=CC2=C(C(=C1)[N+](=O)[O-])NC3=C2C=C(C=C3)[N+](=O)[O-]
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s) no data available
Signal word

no data available

Hazard statement(s)

no data available

Precautionary statement(s)
Prevention

no data available

Response

no data available

Storage

no data available

Disposal

no data available

2.3 Other hazards which do not result in classification

no data available

Computational chemical data
  • Molecular Weight:257.20168g/mol
  • Molecular Formula:C12H7N3O4
  • Exact Mass:257.043656
  • Monoisotopic Mass:257.043656
  • Complexity:391
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:4
  • Topological Polar Surface Area:107
  • Heavy Atom Count:19
  • 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
 
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