CC(C)(C)OC(=O)N1CC(CC1C(=O)O)OCC=C
CAS: 147267-01-4
名称: (2R,4R)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-prop-2-enoxypyrrolidine-2-carboxylic acid
SMILES: CC(C)(C)OC(=O)N1CC(CC1C(=O)O)OCC=C

Molecular Processing

Molecular formula
C13H21NO5
Molecular weight
271.31
Exact mass
271.142
XLogP
1.65
TPSA
76.07
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
19
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.692
Molar refractivity
68.92

Supplementary Information

InChIKey: BLBHRAKGKXHIAB-NXEZZACHSA-N
同義語
(4R)-1-Boc-4-(2-propen-1-yloxy)-D-proline147267-01-4SCHEMBL2203146BLBHRAKGKXHIAB-NXEZZACHSA-NMFCD32263688(2R,4R)-4-(allyloxy)-1-(tert-butoxycarbonyl)pyrrolidine-2-carboxylic acid(2R,4R)-4-allyloxy-1-tert-butoxycarbonyl-pyrrolidine-2-carboxylic acid
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