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107202-39-1 | (S)-tert-Butyl (1-cyclohexyl-2-hydroxyethyl)carbamate
CAS No: 107202-39-1 Catalog No: AG003SU0 MDL No:MFCD04112591
Product Description
Catalog Number:
AG003SU0
Chemical Name:
(S)-tert-Butyl (1-cyclohexyl-2-hydroxyethyl)carbamate
CAS Number:
107202-39-1
Molecular Formula:
C13H25NO3
Molecular Weight:
243.3425
MDL Number:
MFCD04112591
IUPAC Name:
tert-butyl N-[(1S)-1-cyclohexyl-2-hydroxyethyl]carbamate
InChI:
InChI=1S/C13H25NO3/c1-13(2,3)17-12(16)14-11(9-15)10-7-5-4-6-8-10/h10-11,15H,4-9H2,1-3H3,(H,14,16)/t11-/m1/s1
InChI Key:
YNBRORWNNGUYQA-LLVKDONJSA-N
SMILES:
OC[C@H](C1CCCCC1)NC(=O)OC(C)(C)C
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
243.183g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
243.347g/mol
Monoisotopic Mass:
243.183g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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