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Home > Nitro Compounds > 86-15-7
86-15-7 | 4-(2,5-dibutoxy-4-nitrophenyl)morpholine
CAS No: 86-15-7 Catalog No: AG00H0TG MDL No:MFCD00023312
Product Description
Catalog Number:
AG00H0TG
Chemical Name:
4-(2,5-dibutoxy-4-nitrophenyl)morpholine
CAS Number:
86-15-7
Molecular Formula:
C18H28N2O5
Molecular Weight:
352.4253
MDL Number:
MFCD00023312
IUPAC Name:
4-(2,5-dibutoxy-4-nitrophenyl)morpholine
InChI:
InChI=1S/C18H28N2O5/c1-3-5-9-24-17-14-16(20(21)22)18(25-10-6-4-2)13-15(17)19-7-11-23-12-8-19/h13-14H,3-12H2,1-2H3
InChI Key:
MKVBADWWJFSRRK-UHFFFAOYSA-N
SMILES:
CCCCOc1cc([N+](=O)[O-])c(cc1N1CCOCC1)OCCCC
EC Number:
201-652-0
Properties
Complexity:
384
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
352.2g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
352.431g/mol
Monoisotopic Mass:
352.2g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
76.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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