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CAS No.: | 57075-82-8 |
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Name: | 2-bromobenzimidamide hydrochloride |
Molecular Structure: | |
Formula: | C7H8BrClN2 |
Molecular Weight: | 235.5088 |
Synonyms: | Benzenecarboximidamide,2-bromo-, monohydrochloride (9CI);o-Bromobenzamidine hydrochloride; |
Melting Point: | >250 °C(Solv: ethyl ether (60-29-7)) |
Boiling Point: | 272.9 °C at 760 mmHg |
Flash Point: | 118.8 °C |
PSA: | 49.87000 |
LogP: | 3.33520 |
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The CAS register number of Benzenecarboximidamide,2-bromo-, hydrochloride (1:1) is 57075-82-8. It also can be called as 2-Bromobenzamidine hydrochloride and the systematic name about this chemical is 2-bromobenzenecarboximidamide hydrochloride (1:1). The molecular formula about this chemical is C7H8BrClN2 and the molecular weight is 235.5088.
Physical properties about Benzenecarboximidamide,2-bromo-, hydrochloride (1:1) are: (1)ACD/LogP: 1.00; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 2; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 15.6 Å2; (10)Flash Point: 118.8 °C; (11)Enthalpy of Vaporization: 51.12 kJ/mol; (12)Boiling Point: 272.9 °C at 760 mmHg; (13)Vapour Pressure: 0.00593 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Brc1ccccc1C(=[N@H])N.Cl
(2)InChI: InChI=1/C7H7BrN2.ClH/c8-6-4-2-1-3-5(6)7(9)10;/h1-4H,(H3,9,10);1H
(3)InChIKey: RRULRSLJNLFGNK-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C7H7BrN2.ClH/c8-6-4-2-1-3-5(6)7(9)10;/h1-4H,(H3,9,10);1H
(5)Std. InChIKey: RRULRSLJNLFGNK-UHFFFAOYSA-N