CAS No.28959-35-5,GLUTARALDEHYDE SODIUM BISULFITE ADDITION COMPOUND Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	28959-35-5
Name:	GLUTARALDEHYDE SODIUM BISULFITE ADDITION COMPOUND

Formula:	C₅H₁₀Na₂O₈S₂
Molecular Weight:	308.2376
Synonyms:	disodium 1,5-dihydroxypentane-1,5-disulfonate;Glutaraldehyde sodium bisulfite addition compound;disodium 1,5-dihydroxypentane-1,5-disulfonate;Disodium 1,5-dihydroxypentane-1,5-disulfonate;1,5-pentanedisulfonic acid, 1,5-dihydroxy-, sodium salt (1:2);
EINECS:	249-339-8
Melting Point:	>300 °C(lit.)
Safety:	24/25
PSA:	171.62000
LogP:	0.04550

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Specification

The Sodium glutaraldehyde bisulfite, with the CAS registry number 28959-35-5 and EINECS registry number 249-339-8, has the systematic name and IUPAC name of disodium 1,5-dihydroxypentane-1,5-disulfonate. It belongs to the following product categories: Organic Building Blocks; Organic Sulfates/Sulfites; Sulfur Compounds. And the molecular formula of the chemical is C₅H₁₀Na₂O₈S₂. What's more, while dealing with this chemical, you should avoid contacting with skin and eyes.

The characteristics of Sodium glutaraldehyde bisulfite are as followings: (1)ACD/LogP: -4.90; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -9.4; (4)ACD/LogD (pH 7.4): -9.4; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 8; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 143.96 Å².

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: [Na+].[Na+].[O-]S(=O)(=O)C(O)CCCC(O)S([O-])(=O)=O
(2)InChI: InChI=1/C5H12O8S2.2Na/c6-4(14(8,9)10)2-1-3-5(7)15(11,12)13;;/h4-7H,1-3H2,(H,8,9,10)(H,11,12,13);;/q;2*+1/p-2
(3)InChIKey: YGZZDQOCTFVBFC-NUQVWONBAF