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| CAS No.: | 32841-83-1 |
|---|---|
| Name: | 1,1'-FERROCENEDIBORONIC ACID, 97 |
| Article Data: | 2 |
| Molecular Structure: | |
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|
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| Formula: | C10H12B2FeO4 |
| Molecular Weight: | 273.672 |
| Synonyms: | Iron,bis(boronocyclopentadienyl)- (6CI);1,1'-Ferrocenediyldiboronic acid;NSC133354; |
| Melting Point: | 191 °C (dec.)(lit.) |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | 36/37/38 |
| Safety: | 26-36 |
| PSA: | 80.92000 |
| LogP: | -0.92810 |
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Specification
This chemical is called Ferrocene,1,1'-diborono-, and its systematic name is Bis(2-boronocyclopenta-2,4-dien-1-yl)iron. With the molecular formula of C10H12B2FeO4, its molecular weight is 273.67. The CAS registry number of the chemical is 32841-83-1.
Other characteristics of Ferrocene,1,1'-diborono- can be summarised as followings: (1)#H bond acceptors: 4; (2)#H bond donors: 4; (3)#Freely Rotating Bonds: 8; (4)Polar Surface Area: 80.92 Å2.
When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
1.SMILES: B(C1=CC=CC1[Fe]C2C=CC=C2B(O)O)(O)O
2.InChI: InChI=1/2C5H6BO2.Fe/c2*7-6(8)5-3-1-2-4-5;/h2*1-4,7-8H;/rC10H12B2FeO4/c14-11(15)7-3-1-5-9(7)13-10-6-2-4-8(10)12(16)17/h1-6,9-10,14-17H
3.InChIKey: LCJUYSVSRMEAIV-GVRJZXOWAL
4.Std. InChI: InChI=1S/2C5H6BO2.Fe/c2*7-6(8)5-3-1-2-4-5;/h2*1-4,7-8H;
5.Std. InChIKey: LCJUYSVSRMEAIV-UHFFFAOYSA-N