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892502-15-7 | Morpholine,4-[2-(chloromethyl)-4-(trifluoromethyl)phenyl]-
CAS No: 892502-15-7 Catalog No: AG0041V1 MDL No:MFCD09025889
Product Description
Catalog Number:
AG0041V1
Chemical Name:
Morpholine,4-[2-(chloromethyl)-4-(trifluoromethyl)phenyl]-
CAS Number:
892502-15-7
Molecular Formula:
C12H13ClF3NO
Molecular Weight:
279.6859
MDL Number:
MFCD09025889
IUPAC Name:
4-[2-(chloromethyl)-4-(trifluoromethyl)phenyl]morpholine
InChI:
InChI=1S/C12H13ClF3NO/c13-8-9-7-10(12(14,15)16)1-2-11(9)17-3-5-18-6-4-17/h1-2,7H,3-6,8H2
InChI Key:
KCGVSWOLBMMCMW-UHFFFAOYSA-N
SMILES:
ClCc1cc(ccc1N1CCOCC1)C(F)(F)F
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.064g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.687g/mol
Monoisotopic Mass:
279.064g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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