Lapaquistat-d9 Acetate

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英文别名	[1-{[(3R,5S)-1-(3-Acetoxy-2,2-dimethylpropyl)-7-chloro-5-(2,3-dimethoxyphenyl)-2-oxo-1,2,3,5-tetrahydro-4,1-benzoxazepin-3-yl]acetyl}(~2~H_9_)-4-piperidinyl]acetic acid
CAS号	1292841-28-1
SMILES	[2H]C1(C(N(C(C(C1([2H])CC(=O)O)([2H])[2H])([2H])[2H])C(=O)C[C@@H]2C(=O)N(c3ccc(cc3[C@H](O2)c4cccc(c4OC)OC)Cl)CC(C)(C)COC(=O)C)([2H])[2H])[2H]
Inchi	InChI=1S/C33H41ClN2O9/c1-20(37)44-19-33(2,3)18-36-25-10-9-22(34)16-24(25)30(23-7-6-8-26(42-4)31(23)43-5)45-27(32(36)41)17-28(38)35-13-11-21(12-14-35)15-29(39)40/h6-10,16,21,27,30H,11-15,17-19H2,1-5H3,(H,39,40)/t27-,30-/m1/s1/i11D2,12D2,13D2,14D2,21D
InchiKey	CMLUGNQVANVZHY-LUBFGMIQSA-N
分子式 Formula	C33H32D9ClN2O9
分子量 Molecular Weight	654
闪点 FP	453.6±34.3 ℃
沸点 Boiling point	826.4±65.0 ℃ at 760 mmHg
Polarizability极化度	65.6±0.5 10-24cm3
密度 Density	1.2±0.1 g/cm3
蒸汽压 Vapor Pressure	0.0±3.2 mmHg at 25℃
储藏条件 Storage conditions	storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)