Home Other Building Blocks ethyl N-[(benzyloxy)methanethioyl]carbamate

ethyl N-[(benzyloxy)methanethioyl]carbamate

CAS No.:
59965-72-9
Catalog Number:
AG01DWIX
Molecular Formula:
C11H13NO3S
Molecular Weight:
239.2908
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Product Description
Catalog Number:
AG01DWIX
Chemical Name:
ethyl N-[(benzyloxy)methanethioyl]carbamate
CAS Number:
59965-72-9
Molecular Formula:
C11H13NO3S
Molecular Weight:
239.2908
MDL Number:
MFCD20129210
IUPAC Name:
ethyl N-phenylmethoxycarbothioylcarbamate
InChI:
InChI=1S/C11H13NO3S/c1-2-14-10(13)12-11(16)15-8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H,12,13,16)
InChI Key:
JUDUZTLWYNAWGX-UHFFFAOYSA-N
SMILES:
CCOC(=O)NC(=S)OCc1ccccc1
Properties
Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.062g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
239.289g/mol
Monoisotopic Mass:
239.062g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
79.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties