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89538-86-3 | Pyrrolidine, 1-(4-methoxy-6-methyl-2-phenyl-2-heptenyl)-
CAS No: 89538-86-3 Catalog No: AG00403R MDL No:
Product Description
Catalog Number:
AG00403R
Chemical Name:
Pyrrolidine, 1-(4-methoxy-6-methyl-2-phenyl-2-heptenyl)-
CAS Number:
89538-86-3
Molecular Formula:
C19H29NO
Molecular Weight:
287.4397
IUPAC Name:
1-(4-methoxy-6-methyl-2-phenylhept-2-enyl)pyrrolidine
InChI:
InChI=1S/C19H29NO/c1-16(2)13-19(21-3)14-18(15-20-11-7-8-12-20)17-9-5-4-6-10-17/h4-6,9-10,14,16,19H,7-8,11-13,15H2,1-3H3
InChI Key:
GENNUFAFBMRVSX-UHFFFAOYSA-N
SMILES:
COC(C=C(c1ccccc1)CN1CCCC1)CC(C)C
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.225g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
287.447g/mol
Monoisotopic Mass:
287.225g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
4.5
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