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797760-23-7 | Propanamide, 2,2-dimethyl-N-[2-[(1S)-1-phenyl-3-butenyl]phenyl]-
CAS No: 797760-23-7 Catalog No: AG00506H MDL No:
Product Description
Catalog Number:
AG00506H
Chemical Name:
Propanamide, 2,2-dimethyl-N-[2-[(1S)-1-phenyl-3-butenyl]phenyl]-
CAS Number:
797760-23-7
Molecular Formula:
C21H25NO
Molecular Weight:
307.4293
IUPAC Name:
2,2-dimethyl-N-[2-[(1S)-1-phenylbut-3-enyl]phenyl]propanamide
InChI:
InChI=1S/C21H25NO/c1-5-11-17(16-12-7-6-8-13-16)18-14-9-10-15-19(18)22-20(23)21(2,3)4/h5-10,12-15,17H,1,11H2,2-4H3,(H,22,23)/t17-/m0/s1
InChI Key:
WHQMRDDSNHBGPJ-KRWDZBQOSA-N
SMILES:
C=CC[C@H](c1ccccc1NC(=O)C(C)(C)C)c1ccccc1
Properties
Complexity:
389
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
307.194g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
307.437g/mol
Monoisotopic Mass:
307.194g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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