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113932-83-5 | Carbamic acid, (3-ethoxyphenyl)-, methyl ester (9CI)
CAS No: 113932-83-5 Catalog No: AG000A42 MDL No:
Product Description
Catalog Number:
AG000A42
Chemical Name:
Carbamic acid, (3-ethoxyphenyl)-, methyl ester (9CI)
CAS Number:
113932-83-5
Molecular Formula:
C10H13NO3
Molecular Weight:
195.2151
IUPAC Name:
methyl N-(3-ethoxyphenyl)carbamate
InChI:
InChI=1S/C10H13NO3/c1-3-14-9-6-4-5-8(7-9)11-10(12)13-2/h4-7H,3H2,1-2H3,(H,11,12)
InChI Key:
RRYSFAXMLNNQLU-UHFFFAOYSA-N
SMILES:
CCOc1cccc(c1)NC(=O)OC
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
195.218g/mol
Monoisotopic Mass:
195.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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