Basic Information |
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Product Name: | O-ALLYL-N-BENZYLCINCHONDINIUM BROMIDE |
CAS: | 158195-40-5 |
English Synonyms: | O-ALLYL-N-BENZYLCINCHONDINIUM BROMIDE ; O-ALLYL-N-BENZYLCINCHONIDINIUM BROMIDE |
MDL Number.: | MFCD06799017 |
H bond acceptor: | 3 |
H bond donor: | 0 |
Smile: | C=CCO[C@H](c1ccnc2c1cccc2)[C@@H]3C[C@@H]4CC[N+]3(C[C@@H]4C=C)Cc5ccccc5.[Br-] |
InChi: | InChI=1S/C29H33N2O.BrH/c1-3-18-32-29(26-14-16-30-27-13-9-8-12-25(26)27)28-19-24-15-17-31(28,21-23(24)4-2)20-22-10-6-5-7-11-22;/h3-14,16,23-24,28-29H,1-2,15,17-21H2;1H/q+1;/p-1/t23-,24-,28-,29+,31?;/m0./s1 |
InChiKey: | InChIKey=PMBXATROGBSNCU-PCOYAJJYSA-M |
Property |
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Melting Point: | 140-144 DEG C (DEC)(LIT) |
Comments: | OPTICAL ACTIVITY: [ALPHA]20/D -158 DEG, C = 1 IN CHLOROFORM OTHER NOTES: CONTAINS VARYING AMOUNTS OF O-ALLYL-N-BENZYLCINCHONIDINIUM CHLORIDE UNSPSC: 12352100 WGK: 3 |
Safety information |
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Symbol: |
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Signal word: | Warning |
Hazard statements: | H315-H319-H335 |
Precautionary statements: | P261-P305 + P351 + P338 |
hazard symbol: | Xi |
Risk Code: | R:36/37/38 |
Safe Code: | S:26-36 |
WGK Germany: | 3 |
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