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1260611-32-2 | 4-Morpholinecarboxylic acid, 2-(chloromethyl)-, 1,1-dimethylethyl ester, (2S)-
CAS No: 1260611-32-2 Catalog No: AG000QWA MDL No:MFCD13189485
Product Description
Catalog Number:
AG000QWA
Chemical Name:
4-Morpholinecarboxylic acid, 2-(chloromethyl)-, 1,1-dimethylethyl ester, (2S)-
CAS Number:
1260611-32-2
Molecular Formula:
C10H18ClNO3
Molecular Weight:
235.7078
MDL Number:
MFCD13189485
IUPAC Name:
tert-butyl (2S)-2-(chloromethyl)morpholine-4-carboxylate
InChI:
InChI=1S/C10H18ClNO3/c1-10(2,3)15-9(13)12-4-5-14-8(6-11)7-12/h8H,4-7H2,1-3H3/t8-/m1/s1
InChI Key:
LKTUWBGNUYXETD-MRVPVSSYSA-N
SMILES:
ClC[C@H]1OCCN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
235.098g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.708g/mol
Monoisotopic Mass:
235.098g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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