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CAS No.: | 10401-59-9 |
---|---|
Name: | 9-Anthryldiazomethane |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C15H10N2 |
Molecular Weight: | 218.25 |
Synonyms: | Anthracene,9-(diazomethyl)-(8CI,9CI);9-(Diazomethyl)anthracene; |
Melting Point: | 65-67 °C |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-36 |
PSA: | 37.39000 |
LogP: | 3.72276 |
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The CAS registry number of 9-Anthryldiazomethane is 10401-59-9. The IUPAC name is Anthracene,9-(diazomethyl)-. In addition, the formula is C15H10N2 and the molecular weight is 218.25. It should be stored in a cool environment.
Physical properties about this chemical are: (1)ACD/LogP: 3.05; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.05; (4)ACD/LogD (pH 7.4): 3.05; (5)ACD/BCF (pH 5.5): 122.13; (6)ACD/BCF (pH 7.4): 122.13; (7)ACD/KOC (pH 5.5): 1084.83; (8)ACD/KOC (pH 7.4): 1084.83; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 0 Å2; (13)XLogP3: 4.4; (14)H-Bond Acceptor: 1; (15)Heavy Atom Count: 17; (16)Formal Charge: 0; (17)Complexity: 297; (18)Isotope Atom Count: 0; (19)Defined Atom StereoCenter Count: 0; (20)Undefined Atom StereoCenter Count: 0; (21)Defined Bond StereoCenter Count: 0; (22)Undefined Bond StereoCenter Count: 1; (23)Covalently-Bonded Unit Count: 1.
When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: [N-]=[N+]=C\c2c3c(cc1c2cccc1)cccc3
(2)InChI: InChI=1/C15H10N2/c16-17-10-15-13-7-3-1-5-11(13)9-12-6-2-4-8-14(12)15/h1-10H
(3)InChIKey: XXDVOJKRZBNPFN-UHFFFAOYAP