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75912-03-7 | Phenol, 2,6-dimethoxy-,methylcarbamate (9CI)
CAS No: 75912-03-7 Catalog No: AG005HCJ MDL No:
Product Description
Catalog Number:
AG005HCJ
Chemical Name:
Phenol, 2,6-dimethoxy-,methylcarbamate (9CI)
CAS Number:
75912-03-7
Molecular Formula:
C10H13NO4
Molecular Weight:
211.2145
IUPAC Name:
(2,6-dimethoxyphenyl) N-methylcarbamate
InChI:
InChI=1S/C10H13NO4/c1-11-10(12)15-9-7(13-2)5-4-6-8(9)14-3/h4-6H,1-3H3,(H,11,12)
InChI Key:
HXNHUHRBHFQBMI-UHFFFAOYSA-N
SMILES:
CNC(=O)Oc1c(OC)cccc1OC
NSC Number:
36604
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.084g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
211.217g/mol
Monoisotopic Mass:
211.084g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
56.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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