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Home > Nitro Compounds > 761440-65-7

761440-65-7

761440-65-7 | 1-(1-(3-Methoxy-4-nitrophenyl)piperidin-4-yl)-4-Methylpiperazine

CAS No: 761440-65-7 Catalog No: AG00G7J7 MDL No:MFCD18072517

Product Description

Catalog Number:
AG00G7J7
Chemical Name:
1-(1-(3-Methoxy-4-nitrophenyl)piperidin-4-yl)-4-Methylpiperazine
CAS Number:
761440-65-7
Molecular Formula:
C17H26N4O3
Molecular Weight:
334.4133
MDL Number:
MFCD18072517
IUPAC Name:
1-[1-(3-methoxy-4-nitrophenyl)piperidin-4-yl]-4-methylpiperazine
InChI:
InChI=1S/C17H26N4O3/c1-18-9-11-20(12-10-18)14-5-7-19(8-6-14)15-3-4-16(21(22)23)17(13-15)24-2/h3-4,13-14H,5-12H2,1-2H3
InChI Key:
HNYSXOZEEKWPNM-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1[N+](=O)[O-])N1CCC(CC1)N1CCN(CC1)C

Properties

Complexity:
415  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
334.2g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
334.42g/mol
Monoisotopic Mass:
334.2g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
64.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

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