Home Other Building Blocks 3-{[(3-methylcyclohexyl)oxy]methyl}aniline

3-{[(3-methylcyclohexyl)oxy]methyl}aniline

CAS No.:
1037157-93-9
Catalog Number:
AG01A7N0
Molecular Formula:
C14H21NO
Molecular Weight:
219.3226
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Product Description
Catalog Number:
AG01A7N0
Chemical Name:
3-{[(3-methylcyclohexyl)oxy]methyl}aniline
CAS Number:
1037157-93-9
Molecular Formula:
C14H21NO
Molecular Weight:
219.3226
MDL Number:
MFCD11196406
IUPAC Name:
3-[(3-methylcyclohexyl)oxymethyl]aniline
InChI:
InChI=1S/C14H21NO/c1-11-4-2-7-14(8-11)16-10-12-5-3-6-13(15)9-12/h3,5-6,9,11,14H,2,4,7-8,10,15H2,1H3
InChI Key:
KQZCTCPMAVVCSZ-UHFFFAOYSA-N
SMILES:
CC1CCCC(C1)OCc1cccc(c1)N
Properties
Complexity:
207  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.162g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
219.328g/mol
Monoisotopic Mass:
219.162g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties