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839710-38-2 | (S);-2-(4-(tert-Butoxycarbonyl);morpholin-3-yl);acetic acid
CAS No: 839710-38-2 Catalog No: AG003CKD MDL No:MFCD09264263
Product Description
Catalog Number:
AG003CKD
Chemical Name:
(S);-2-(4-(tert-Butoxycarbonyl);morpholin-3-yl);acetic acid
CAS Number:
839710-38-2
Molecular Formula:
C11H19NO5
Molecular Weight:
245.2723
MDL Number:
MFCD09264263
IUPAC Name:
2-[(3S)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholin-3-yl]acetic acid
InChI:
InChI=1S/C11H19NO5/c1-11(2,3)17-10(15)12-4-5-16-7-8(12)6-9(13)14/h8H,4-7H2,1-3H3,(H,13,14)/t8-/m0/s1
InChI Key:
QVOPNRRQHPWQMF-QMMMGPOBSA-N
SMILES:
OC(=O)C[C@H]1COCCN1C(=O)OC(C)(C)C
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
245.126g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.275g/mol
Monoisotopic Mass:
245.126g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
76.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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