Name: | BENZOIC ACID (RING-13C6) |
CAS: | 125945-98-4 |
Synonyms: | BENZOIC ACID (RING-13C6) ; BENZOIC-RING-13C6 ACID 99 ATOM % 13C |
MDL.: | MFCD00143673 |
H bond acceptor: | 2 |
H bond donor: | 1 |
Smile: | [13cH]1[13cH][13cH][13c]([13cH][13cH]1)C(=O)O |
InChi: | InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)/i1+1,2+1,3+1,4+1,5+1,6+1 |
InChiKey: | InChIKey=WPYMKLBDIGXBTP-IDEBNGHGSA-N |
Property |
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Melting Point: | 121-125 DEG C(LIT) |
Boiling Point: | 249 DEG C(LIT) |
Comments: | MASS SHIFT: M+6 UNSPSC: 12142200 WGK: 3 |
Information: | ISOTOPIC PURITY: 99 ATOM % 13C MW: 128.02 BY ATOM % CALCULATION |
Safety information |
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Symbol: |
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Signal word: | Danger |
Hazard statements: | H302-H315-H317-H318-H334-H335 |
Precautionary statements: | P261-P280-P305 + P351 + P338-P342 + P311 |
hazard symbol: | Xn |
Risk Code: | R:22-37/38-41-42/43 |
Safe Code: | S:22-26-36 |
WGK Germany: | 3 |
BENZOIC ACID (RING-13C6)
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