Carbamic acid, [(1R)-1-(4-bromophenyl)ethyl]-, 1,1-dimethylethyl ester


Chemical Name: Carbamic acid, [(1R)-1-(4-bromophenyl)ethyl]-, 1,1-dimethylethyl ester
CAS Number: 578729-21-2
Product Number: AG003CBN(AGN-PC-0OCN2O)
Synonyms:
MDL No: MFCD11506010
Molecular Formula: C13H18BrNO2
Molecular Weight: 300.1915

Identification/Properties


Properties
MP:
131-135 ºC
BP:
383.1°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
300.196g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
4
Exact Mass:
299.052g/mol
Monoisotopic Mass:
299.052g/mol
Topological Polar Surface Area:
38.3A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
255
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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