2,6-二氨-8-别嘌醇硫酸盐

CAS号
698998-94-6 ;123333-49-3
CCD编号
CCD00074374
分子式
2 C5 H6 N6 O . H2 O . H2 O4 S
分子量
448.379

基本信息

产品名称: 2,6-二氨-8-别嘌醇硫酸盐
CAS: 698998-94-6 ;123333-49-3
中文同义词: 2,6-二氨-8-别嘌醇硫酸盐
英文同义词: 2,6-DIAMINO-8-PURINOL HEMISULFATE SALT HYDRATE ; 2,6-DIAMINO-8-PURINOL HEMISULFATE MONOHYDRATE
MDL号: MFCD00150148
氢键受体数量: 7
氢键供体数量: 4
Smile: c12c(nc(nc1nc([nH]2)O)N)N.c12c(nc(nc1nc([nH]2)O)N)N.O.OS(=O)(=O)O
InChi: InChI=1S/2C5H6N6O.H2O4S.H2O/c2*6-2-1-3(10-4(7)9-2)11-5(12)8-1;1-5(2,3)4;/h2*(H6,6,7,8,9,10,11,12);(H2,1,2,3,4);1H2
InChiKey: InChIKey=RYLHSHJARAETPO-UHFFFAOYSA-N

性质

熔点: 324-329 DEG C(LIT)
注解: UNSPSC: 12352100
WGK: 3

安全信息

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