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1257665-14-7

1257665-14-7 | Benzamide, 4-bromo-N-(1,1-dimethylethyl)-2-methoxy-

CAS No: 1257665-14-7 Catalog No: AG000OO3 MDL No:MFCD18087701

Product Description

Catalog Number:
AG000OO3
Chemical Name:
Benzamide, 4-bromo-N-(1,1-dimethylethyl)-2-methoxy-
CAS Number:
1257665-14-7
Molecular Formula:
C12H16BrNO2
Molecular Weight:
286.1649
MDL Number:
MFCD18087701
IUPAC Name:
4-bromo-N-tert-butyl-2-methoxybenzamide
InChI:
InChI=1S/C12H16BrNO2/c1-12(2,3)14-11(15)9-6-5-8(13)7-10(9)16-4/h5-7H,1-4H3,(H,14,15)
InChI Key:
VAKOMRBUUFURNP-UHFFFAOYSA-N
SMILES:
COc1cc(Br)ccc1C(=O)NC(C)(C)C

Properties

Complexity:
250  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.036g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
286.169g/mol
Monoisotopic Mass:
285.036g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  

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