Search Result : Detailed Informations

Low Mol Weight Allergen Name	CAS#	CID
2,5-Diaminotoluene sulfate	615-50-9	22856

Structure

Other Information

Canonical SMILES	CC1=C(C=CC(=C1)N)N.OS(=O)(=O)O
Iso SMILES	CC1=C(C=CC(=C1)N)N.OS(=O)(=O)O
InChI	InChI=1S/C7H10N2.H2O4S/c1-5-4-6(8)2-3-7(5)9;1-5(2,3)4/h2-4H,8-9H2,1H3;(H2,1,2,3,4)
InChI Key	KZTWOUOZKZQDMN-UHFFFAOYSA-N
Formula	C7H12N2O4S
Mol Weight	220.246
XlogP3	0
Charge	0

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Synonyms Information

CAS Name	2-methylbenzene-1,4-diamine; sulfuric acid
IUPAC Name	2-methylbenzene-1,4-diamine; sulfuric acid
Openeye Name	2-methylbenzene-1,4-diamine; sulfuric acid
Systematic Name	2-methylbenzene-1,4-diamine; sulfuric acid
Tratitional Name	2-methylbenzene-1,4-diamine; sulfuric acid