缬氨酸苄酯对甲苯磺酸盐

CAS号
16652-76-9
CCD编号
CCD00025277
分子式
C12 H17 N O2 . C7 H8 O3 S
分子量
379.474

基本信息

产品名称: 缬氨酸苄酯对甲苯磺酸盐
CAS: 16652-76-9
中文同义词: L-缬氨酸苄酯对甲苯磺酸盐 ; 缬氨酸苄酯对甲苯磺酸盐
英文同义词: L-VALINE BENZYL ESTER TOLUENE-4-SULFONATE ; L-VALINE BENZYL ESTER 4-TOLUENESULFONATE SALT ; H-VAL-OBZL TOSOH ; L-VAL-OBZL TOSOH ; L-VALINE BENZYL ESTER P-TOLUENESULFONAT SALT ; L-VALINE BENZYL ESTER-P-TOSYLATE ; (2S)-1-(BENZYLOXY)-3-METHYL-1-OXO-2-BUTANAMINIUM-4-METHYLBENZENESULFONATE ; BENZYL L-VALINATE P-TOLUENESULFONATE ; BENZYL L-VALINATE TOSYLATE ; L-VALINE BENZYL ESTER P-TOLUENESULFONATE SALT ; (S)-BENZYL 2-AMINO-3-METHYLBUTANOATE 4-METHYLBENZENESULFONATE ; L-VALINE BENZYL ESTER TOSYLATE ; H-VAL-OBZL P-TOSYLATE ; H-L-VAL-OBZL TOS ; L-VALINE BENZYL ESTER P-TOLUENESULFONATE ; L-VALINE BENZYL ESTER 4-TOLUENESULFONATE ; H-VAL-OBZL TOS ; VAL-OBZL TOSOH
MDL号: MFCD00038908
氢键受体数量: 3
氢键供体数量: 1
Smile: Cc1ccc(cc1)S(=O)(=O)O.CC(C)[C@@H](C(=O)OCc1ccccc1)N
InChi: InChI=1S/C12H17NO2.C7H8O3S/c1-9(2)11(13)12(14)15-8-10-6-4-3-5-7-10;1-6-2-4-7(5-3-6)11(8,9)10/h3-7,9,11H,8,13H2,1-2H3;2-5H,1H3,(H,8,9,10)/t11-;/m0./s1
InChiKey: InChIKey=QWUQVUDPBXFOKF-MERQFXBCSA-N

性质

熔点: 160-160 DEG C/160~162℃
注解: OPTICAL ACTIVITY: [ALPHA]20/D -3.7+/-0.3 DEG, C = 3.2% IN METHANOL
UNSPSC: 12352100
WGK: 3

安全信息

安全声明: S:22,24/25
WGK德国: 3

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