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17863-56-8 | Carbamic acid, (hydroxymethyl)-, 2-(1-methylethyl)phenyl ester (9CI)
CAS No: 17863-56-8 Catalog No: AG00267Y MDL No:
Product Description
Catalog Number:
AG00267Y
Chemical Name:
Carbamic acid, (hydroxymethyl)-, 2-(1-methylethyl)phenyl ester (9CI)
CAS Number:
17863-56-8
Molecular Formula:
C11H15NO3
Molecular Weight:
209.2417
IUPAC Name:
(2-propan-2-ylphenyl) N-(hydroxymethyl)carbamate
InChI:
InChI=1S/C11H15NO3/c1-8(2)9-5-3-4-6-10(9)15-11(14)12-7-13/h3-6,8,13H,7H2,1-2H3,(H,12,14)
InChI Key:
IAPSPMRZZVIOCU-UHFFFAOYSA-N
SMILES:
OCNC(=O)Oc1ccccc1C(C)C
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.105g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
209.245g/mol
Monoisotopic Mass:
209.105g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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