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28685-39-4 | Phenol, 2-chloro-4-(dimethylamino)-3,5-dimethyl-, methylcarbamate (ester) (9CI)
CAS No: 28685-39-4 Catalog No: AG002W3C MDL No:
Product Description
Catalog Number:
AG002W3C
Chemical Name:
Phenol, 2-chloro-4-(dimethylamino)-3,5-dimethyl-, methylcarbamate (ester) (9CI)
CAS Number:
28685-39-4
IUPAC Name:
[2-chloro-4-(dimethylamino)-3,5-dimethylphenyl] N-methylcarbamate
InChI:
InChI=1S/C12H17ClN2O2/c1-7-6-9(17-12(16)14-3)10(13)8(2)11(7)15(4)5/h6H,1-5H3,(H,14,16)
InChI Key:
IJGSNIANMOHXAF-UHFFFAOYSA-N
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.098g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
256.73g/mol
Monoisotopic Mass:
256.098g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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