CAS No.584-98-5,(S)-(-)-2-Bromosuccinic acid Suppliers

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Basic Information

Molecular Structure:
CAS No.:	584-98-5
Name:	(S)-(-)-2-Bromosuccinic acid
Article Data:	64

Formula:	C₄H₅BrO₄
Molecular Weight:	196.985
Synonyms:	Butanedioic acid, 2-bromo-, (2S)-;(S)-(-)Bromosuccinic acid;
Density:	2.022 g/cm³
Melting Point:	161°C
Boiling Point:	255.1 °C at 760 mmHg
Flash Point:	108.1 °C
PSA:	74.60000
LogP:	0.30920

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Specification

The CAS register number of (S)-(-)-2-Bromosuccinic acid is 584-98-5. It also can be called as Butanedioic acid, 2-bromo-, (2S)- and the systematic name about this chemical is (2S)-2-bromobutanedioic acid. The molecular formula about this chemical is C₄H₅BrO₄and the molecular weight is 196.98.

Physical properties about (S)-(-)-2-Bromosuccinic acid are: (1)ACD/LogP: 0.60; (2)ACD/LogD (pH 5.5): -3.2; (3)ACD/LogD (pH 7.4): -4.14; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 52.6Å²; (12)Index of Refraction: 1.558; (13)Molar Refractivity: 31.39 cm³; (14)Molar Volume: 97.3 cm³; (15)Polarizability: 12.44x10^-24cm³; (16)Surface Tension: 72.7 dyne/cm; (17)Enthalpy of Vaporization: 54.23 kJ/mol; (18)Boiling Point: 255.1 °C at 760 mmHg; (19)Vapour Pressure: 0.00512 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Br[C@H](C(=O)O)CC(=O)O
(2)InChI: InChI=1/C4H5BrO4/c5-2(4(8)9)1-3(6)7/h2H,1H2,(H,6,7)(H,8,9)/t2-/m0/s1
(3)InChIKey: QQWGVQWAEANRTK-REOHCLBHBZ
(4)Std. InChI: InChI=1S/C4H5BrO4/c5-2(4(8)9)1-3(6)7/h2H,1H2,(H,6,7)(H,8,9)/t2-/m0/s1
(5)Std. InChIKey: QQWGVQWAEANRTK-REOHCLBHSA-N