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1233521-09-9 | 3-(Difluoromethoxy)-N-methylaniline
CAS No: 1233521-09-9 Catalog No: AG01FDU3 MDL No:MFCD11655735
Product Description
Catalog Number:
AG01FDU3
Chemical Name:
3-(Difluoromethoxy)-N-methylaniline
CAS Number:
1233521-09-9
Molecular Formula:
C8H9F2NO
Molecular Weight:
173.1600
MDL Number:
MFCD11655735
IUPAC Name:
3-(difluoromethoxy)-N-methylaniline
InChI:
InChI=1S/C8H9F2NO/c1-11-6-3-2-4-7(5-6)12-8(9)10/h2-5,8,11H,1H3
InChI Key:
OHFUZDGTOMMUDC-UHFFFAOYSA-N
SMILES:
CNc1cccc(c1)OC(F)F
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.065g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
173.163g/mol
Monoisotopic Mass:
173.065g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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