Home Other Building Blocks 3-[(tert-butoxy)methyl]-2-methylaniline

3-[(tert-butoxy)methyl]-2-methylaniline

CAS No.:
1156812-33-7
Catalog Number:
AG019TOY
Molecular Formula:
C12H19NO
Molecular Weight:
193.2854
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Product Description
Catalog Number:
AG019TOY
Chemical Name:
3-[(tert-butoxy)methyl]-2-methylaniline
CAS Number:
1156812-33-7
Molecular Formula:
C12H19NO
Molecular Weight:
193.2854
MDL Number:
MFCD12186488
IUPAC Name:
2-methyl-3-[(2-methylpropan-2-yl)oxymethyl]aniline
InChI:
InChI=1S/C12H19NO/c1-9-10(6-5-7-11(9)13)8-14-12(2,3)4/h5-7H,8,13H2,1-4H3
InChI Key:
AGRRAFIZIRFXQL-UHFFFAOYSA-N
SMILES:
CC(OCc1cccc(c1C)N)(C)C
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.147g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
193.29g/mol
Monoisotopic Mass:
193.147g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties