Home Other Building Blocks 2-methyl-3-[(propan-2-yloxy)methyl]aniline

2-methyl-3-[(propan-2-yloxy)methyl]aniline

CAS No.:
1157090-24-8
Catalog Number:
AG019QME
Molecular Formula:
C11H17NO
Molecular Weight:
179.2588
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Product Description
Catalog Number:
AG019QME
Chemical Name:
2-methyl-3-[(propan-2-yloxy)methyl]aniline
CAS Number:
1157090-24-8
Molecular Formula:
C11H17NO
Molecular Weight:
179.2588
MDL Number:
MFCD12186484
IUPAC Name:
2-methyl-3-(propan-2-yloxymethyl)aniline
InChI:
InChI=1S/C11H17NO/c1-8(2)13-7-10-5-4-6-11(12)9(10)3/h4-6,8H,7,12H2,1-3H3
InChI Key:
VQKDSCWMZCIEGA-UHFFFAOYSA-N
SMILES:
CC(OCc1cccc(c1C)N)C
Properties
Complexity:
147  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.131g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
179.263g/mol
Monoisotopic Mass:
179.131g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties