Home Carbonyls Carbamic acid, N-[(1S,2R)-2-hydroxy-1-[[[(tetrahydro-2H-pyran-2-yl)oxy]amino]carbonyl]propyl]-, phenylmethyl ester

Carbamic acid, N-[(1S,2R)-2-hydroxy-1-[[[(tetrahydro-2H-pyran-2-yl)oxy]amino]carbonyl]propyl]-, phenylmethyl ester

CAS No.:
1820598-87-5
Catalog Number:
AG0023BK
Molecular Formula:
C17H24N2O6
Molecular Weight:
352.3823
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Product Description
Catalog Number:
AG0023BK
Chemical Name:
Carbamic acid, N-[(1S,2R)-2-hydroxy-1-[[[(tetrahydro-2H-pyran-2-yl)oxy]amino]carbonyl]propyl]-, phenylmethyl ester
CAS Number:
1820598-87-5
Molecular Formula:
C17H24N2O6
Molecular Weight:
352.3823
MDL Number:
MFCD27992080
IUPAC Name:
benzyl N-[(2S,3R)-3-hydroxy-1-(oxan-2-yloxyamino)-1-oxobutan-2-yl]carbamate
InChI:
InChI=1S/C17H24N2O6/c1-12(20)15(16(21)19-25-14-9-5-6-10-23-14)18-17(22)24-11-13-7-3-2-4-8-13/h2-4,7-8,12,14-15,20H,5-6,9-11H2,1H3,(H,18,22)(H,19,21)/t12-,14?,15+/m1/s1
InChI Key:
ZSUYSCQLCQPTII-ATFAPYMMSA-N
SMILES:
O=C(N[C@H](C(=O)NOC1CCCCO1)[C@H](O)C)OCc1ccccc1
Properties
Complexity:
427  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
352.163g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
352.387g/mol
Monoisotopic Mass:
352.163g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties