1-Pyrrolidinecarboxylic acid, 3-acetyl-4-ethyl-, phenylmethyl ester, (3R,4S)-
한글명:1-Pyrrolidinecarboxylic acid, 3-acetyl-4-ethyl-, phenylmethyl ester, (3R,4S)-
카스 번호2411540-29-7
상품명:1-Pyrrolidinecarboxylic acid, 3-acetyl-4-ethyl-, phenylmethyl ester, (3R,4S)-
CBNumberCB58358528
분자식C16H21NO3
포뮬러 무게275.34
MOL 파일2411540-29-7.mol
화학적 성질
끓는 점 | 401.7±45.0 °C(Predicted) |
밀도 | 1.115±0.06 g/cm3(Predicted) |
산도 계수 (pKa) | -2.58±0.60(Predicted) |
InChI | InChI=1S/C16H21NO3/c1-3-14-9-17(10-15(14)12(2)18)16(19)20-11-13-7-5-4-6-8-13/h4-8,14-15H,3,9-11H2,1-2H3/t14-,15-/m1/s1 |
InChIKey | IDAIPNZJYAVREK-HUUCEWRRSA-N |
SMILES | N1(C(OCC2=CC=CC=C2)=O)C[C@@H](CC)[C@@H](C(C)=O)C1 |