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Home> Encyclopedia > Hot Product Listed 6   > 6-Oxa-9-azaspiro[4.5]decane-9-carboxylicacid, 1,1-dimethylethyl ester
55231-64-6 structure

6-Oxa-9-azaspiro[4.5]decane-9-carboxylicacid, 1,1-dimethylethyl ester

Iupac Name:1,2,3,4,5-pentakis(bromomethyl)benzene
CAS No.:55231-64-6
Molecular Weight:542.729
Molecular Formula:C9H8N2O (isomer)
Names and Identifiers
Synonyms

1,1-dimethylethyl 6-oxa-9-azaspiro[4.5]decane-9-carboxylate 6-oxa-9-azaspiro[4.5]decane-9-carboxylic acid 1,1-dimethylethyl ester 6-oxa-9-azaspiro[4.5]decane-9-carboxylic acid tert-butyl ester 9-boc-6-oxa-9-azaspiro[4.5]decane AC1LTTCC acm271245397 AK396627 AKOS027381942 B50620 CTK4F9110 DTXSID60363860 fch1623570 FT-0753460 HE051779 mfcd04038530 SCHEMBL714947 tert-butyl 10-oxa-7-azaspiro[4.5]decane-7-carboxylate tert-butyl 6-oxa-9-azaspiro[4.5]decane-9-carboxylate ZINC1436149 ZNLFHUVQLZVBKM-UHFFFAOYSA-N

Inchi
InChI=1S/C11H11Br5/c12-2-7-1-8(3-13)10(5-15)11(6-16)9(7)4-14/h1H,2-6H2
InChkey
IVNSAUPBGDNDGZ-UHFFFAOYSA-N
Canonical Smiles
C1=C(C(=C(C(=C1CBr)CBr)CBr)CBr)CBr
Properties
Refractive Index
1.679
Flash Point
218°C
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:542.729g/mol
  • Molecular Formula:C9H8N2O
  • Compound Is Canonicalized:True
  • Exact Mass:541.674
  • Monoisotopic Mass:537.678
  • Complexity:181
  • Rotatable Bond Count:5
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:0
  • Heavy Atom Count:16
  • 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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