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88309-83-5 | Carbamic acid, ethenyl-, 3-methyl-5-(1-methylethyl)phenyl ester
CAS No: 88309-83-5 Catalog No: AG00493A MDL No:
Product Description
Catalog Number:
AG00493A
Chemical Name:
Carbamic acid, ethenyl-, 3-methyl-5-(1-methylethyl)phenyl ester
CAS Number:
88309-83-5
Molecular Formula:
C13H17NO2
Molecular Weight:
219.2796
IUPAC Name:
(3-methyl-5-propan-2-ylphenyl) N-ethenylcarbamate
InChI:
InChI=1S/C13H17NO2/c1-5-14-13(15)16-12-7-10(4)6-11(8-12)9(2)3/h5-9H,1H2,2-4H3,(H,14,15)
InChI Key:
MGXCROPAPIMFHF-UHFFFAOYSA-N
SMILES:
C=CNC(=O)Oc1cc(C)cc(c1)C(C)C
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.126g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
219.284g/mol
Monoisotopic Mass:
219.126g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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