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128208-32-2 | 1H-1-Benzazepine, 4,5-dihydro-1,3,5-trimethyl-
CAS No: 128208-32-2 Catalog No: AG000XV1 MDL No:
Product Description
Catalog Number:
AG000XV1
Chemical Name:
1H-1-Benzazepine, 4,5-dihydro-1,3,5-trimethyl-
CAS Number:
128208-32-2
Molecular Formula:
C13H17N
Molecular Weight:
187.2808
IUPAC Name:
1,3,5-trimethyl-4,5-dihydro-1-benzazepine
InChI:
InChI=1S/C13H17N/c1-10-8-11(2)12-6-4-5-7-13(12)14(3)9-10/h4-7,9,11H,8H2,1-3H3
InChI Key:
WORFZNXWSKZXGW-UHFFFAOYSA-N
SMILES:
CC1=CN(C)c2c(C(C1)C)cccc2
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.136g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
187.286g/mol
Monoisotopic Mass:
187.136g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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