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101137-69-3 | Carbamic acid, benzoylphenyl-, 1,1-dimethylethyl ester (9CI)
CAS No: 101137-69-3 Catalog No: AG0003TI MDL No:
Product Description
Catalog Number:
AG0003TI
Chemical Name:
Carbamic acid, benzoylphenyl-, 1,1-dimethylethyl ester (9CI)
CAS Number:
101137-69-3
Molecular Formula:
C18H19NO3
Molecular Weight:
297.3484
IUPAC Name:
tert-butyl N-benzoyl-N-phenylcarbamate
InChI:
InChI=1S/C18H19NO3/c1-18(2,3)22-17(21)19(15-12-8-5-9-13-15)16(20)14-10-6-4-7-11-14/h4-13H,1-3H3
InChI Key:
VVXMEWKQSYPWEI-UHFFFAOYSA-N
SMILES:
O=C(N(C(=O)c1ccccc1)c1ccccc1)OC(C)(C)C
Properties
Complexity:
388
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.136g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.354g/mol
Monoisotopic Mass:
297.136g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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