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154016-57-6 | Carbamic acid,N-[(3-methyl-5-isoxazolyl)methyl]-, 1,1-dimethylethyl ester
CAS No: 154016-57-6 Catalog No: AG00HY74 MDL No:MFCD06795882
Product Description
Catalog Number:
AG00HY74
Chemical Name:
Carbamic acid,N-[(3-methyl-5-isoxazolyl)methyl]-, 1,1-dimethylethyl ester
CAS Number:
154016-57-6
MDL Number:
MFCD06795882
IUPAC Name:
tert-butyl N-[(3-bromo-1,2-oxazol-5-yl)methyl]carbamate
InChI:
InChI=1S/C9H13BrN2O3/c1-9(2,3)14-8(13)11-5-6-4-7(10)12-15-6/h4H,5H2,1-3H3,(H,11,13)
InChI Key:
XKNWOSFDTIOWTB-UHFFFAOYSA-N
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.011g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
277.118g/mol
Monoisotopic Mass:
276.011g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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