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29285-54-9 | Carbamic acid, dimethyl-, 2-allyl-4-chlorophenyl ester (8CI)
CAS No: 29285-54-9 Catalog No: AG002XZ0 MDL No:
Product Description
Catalog Number:
AG002XZ0
Chemical Name:
Carbamic acid, dimethyl-, 2-allyl-4-chlorophenyl ester (8CI)
CAS Number:
29285-54-9
Molecular Formula:
C12H14ClNO2
Molecular Weight:
239.6981
IUPAC Name:
(4-chloro-2-prop-2-enylphenyl) N,N-dimethylcarbamate
InChI:
InChI=1S/C12H14ClNO2/c1-4-5-9-8-10(13)6-7-11(9)16-12(15)14(2)3/h4,6-8H,1,5H2,2-3H3
InChI Key:
HURXEQUUKDZSTL-UHFFFAOYSA-N
SMILES:
C=CCc1cc(Cl)ccc1OC(=O)N(C)C
NSC Number:
14559
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.071g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.699g/mol
Monoisotopic Mass:
239.071g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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