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70424-77-0 | DIETHYL[2-[(3,7,7-TRIMETHYLBICYCLO[4.1.0]HEPT-3-EN-2-YL)METHOXY]ETHYL]AMINE
CAS No: 70424-77-0 Catalog No: AG005IYC MDL No:
Product Description
Catalog Number:
AG005IYC
Chemical Name:
DIETHYL[2-[(3,7,7-TRIMETHYLBICYCLO[4.1.0]HEPT-3-EN-2-YL)METHOXY]ETHYL]AMINE
CAS Number:
70424-77-0
Molecular Formula:
C17H31NO
Molecular Weight:
265.4341
IUPAC Name:
N,N-diethyl-2-[(3,7,7-trimethyl-2-bicyclo[4.1.0]hept-3-enyl)methoxy]ethanamine
InChI:
InChI=1S/C17H31NO/c1-6-18(7-2)10-11-19-12-14-13(3)8-9-15-16(14)17(15,4)5/h8,14-16H,6-7,9-12H2,1-5H3
InChI Key:
PULVHGXFJNZOLV-UHFFFAOYSA-N
SMILES:
CCN(CCOCC1C(=CCC2C1C2(C)C)C)CC
EC Number:
274-602-9
Properties
Complexity:
330
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.241g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.441g/mol
Monoisotopic Mass:
265.241g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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