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529-81-7

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529-81-7 Structure

529-81-7 Structure
IdentificationBack Directory
[Name]

TROGER'S BASE
[CAS]

529-81-7
[Synonyms]

NSC 68211
Troger base
Troeger Base
troeger’sbase
TROGER'S BASE
Troger's base 1
Troger's Base 98%
Ethano-Troger's base
12h-5,11-methanodibenzo(b,f)(1,5)diazocine,2,8-dimethyl-6
6H,12H-2,8-Dimethyl-5,11-methanodibenzo[b,f][1,5]diazocine
2,8-DIMETHYL-6H,12H-5,11-METHANODIBENZO[B,F][1,5]DIAZOCINE
2,8-Dimethyl-5,11-methano-6H,12H-dibenzo[b,f][1,5]diazocine
6H,12H-5,11-Methanodibenzo[B,F][1,5]diazocine, 2,8-dimethyl-
2,8-Dimethyl-6,12-dihydro-5,11-methanodibenzo[b,f][1,5]diazocine
2,8-Dimethyl-5,11-methano-5H,6H,11H,12H-dibenzo[b,f][1,5]diazocine
2,8-Dimethyl-5,11-methano-5,6,11,12-tetrahydrodibenzo[b,f][1,5]diazocine
Troger’s Base,2,8-Dimethyl-6H,12H-5,11-methanodibenzo[b,f][1,5]diazocine
Inchi=1/C17H18N2/C1-12-3-5-16-14(7-12)9-18-11-19(16)10-15-8-13(2)4-6-17(15)18/H3-8H,9-11H2,1-2h
[Molecular Formula]

C17H18N2
[MDL Number]

MFCD00134397
[MOL File]

529-81-7.mol
[Molecular Weight]

250.34
Chemical PropertiesBack Directory
[Melting point ]

133-136 °C(lit.)
[Boiling point ]

461.0±45.0 °C(Predicted)
[density ]

1.21±0.1 g/cm3(Predicted)
[form ]

powder
[pka]

4.53±0.20(Predicted)
[InChI]

1S/C17H18N2/c1-12-3-5-16-14(7-12)9-18-11-19(16)10-15-8-13(2)4-6-17(15)18/h3-8H,9-11H2,1-2H3
[InChIKey]

SXPSZIHEWFTLEQ-UHFFFAOYSA-N
[SMILES]

Cc1ccc2[N@@H]3C[N@@H](Cc2c1)c4ccc(C)cc4C3
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-36
[WGK Germany ]

3
[RTECS ]

PB9260000
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Spectrum DetailBack Directory
[Spectrum Detail]

TROGER'S BASE(529-81-7)1HNMR
TROGER'S BASE(529-81-7)IR
TROGER'S BASE(529-81-7)Raman
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