Rhodamine 700
HIT212717963
sdf文件结构编辑类似物检索
HIT ID: HIT212717963
Cas No: 63561-42-2
分子式: C26H26ClF3N2O5
分子量: 538.95
常用名: Rhodamine 700
氢键受体数 (HBA): 3
氢键供体数 (HBD): 0
LogP: 7.0470576
IUPAC: 16-(trifluoromethyl)-3lambda4-oxa-9,23-diazaheptacyclo[17.7.1.1^{5,9}.0^{2,17}.0^{4,15}.0^{23,27}.0^{13,28}]octacosa-1,3,5(28),13,15,17,19(27)-heptaen-3-ylium perchlorate
IUPAC: 16-(trifluoromethyl)-3lambda4-oxa-9,23-diazaheptacyclo[17.7.1.1^{5,9}.0^{2,17}.0^{4,15}.0^{23,27}.0^{13,28}]octacosa-1,3,5(28),13,15,17,19(27)-heptaen-3-ylium perchlorate
SMILES: [O-][Cl](=O)(=O)=O.FC(F)(F)c1c2cc3CCCN4CCCc(c34)c2[o+]c2c3CCCN4CCCc(cc12)c34
SMILES: [O-][Cl](=O)(=O)=O.FC(F)(F)c1c2cc3CCCN4CCCc(c34)c2[o+]c2c3CCCN4CCCc(cc12)c34
InChI key: HTNRBNPBWAFIKA-UHFFFAOYSA-M
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TargetMol
SC
10600 购物车
Mcule
SC
36964-5周 购物车
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