Home Other Building Blocks 8-methoxy-2,2-dimethyl-2,3,4,5-tetrahydro-1,4-benzoxazepine

8-methoxy-2,2-dimethyl-2,3,4,5-tetrahydro-1,4-benzoxazepine

CAS No.:
1784180-64-8
Catalog Number:
AG01C2FO
Molecular Formula:
C12H17NO2
Molecular Weight:
207.2689
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Product Description
Catalog Number:
AG01C2FO
Chemical Name:
8-methoxy-2,2-dimethyl-2,3,4,5-tetrahydro-1,4-benzoxazepine
CAS Number:
1784180-64-8
Molecular Formula:
C12H17NO2
Molecular Weight:
207.2689
MDL Number:
MFCD29762709
IUPAC Name:
8-methoxy-2,2-dimethyl-4,5-dihydro-3H-1,4-benzoxazepine
InChI:
InChI=1S/C12H17NO2/c1-12(2)8-13-7-9-4-5-10(14-3)6-11(9)15-12/h4-6,13H,7-8H2,1-3H3
InChI Key:
XQPKDOZXNBJOIV-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)OC(C)(C)CNC2
Properties
Complexity:
218  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.126g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
207.273g/mol
Monoisotopic Mass:
207.126g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
30.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties