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745784-08-1 | (S)-(-)-1-(3-Methoxyphenyl)ethyl isocyanate, 97%
CAS No: 745784-08-1 Catalog No: AG003CD0 MDL No:
Product Description
Catalog Number:
AG003CD0
Chemical Name:
(S)-(-)-1-(3-Methoxyphenyl)ethyl isocyanate, 97%
CAS Number:
745784-08-1
IUPAC Name:
1-[(1S)-1-isocyanatoethyl]-3-methoxybenzene
InChI:
InChI=1S/C10H11NO2/c1-8(11-7-12)9-4-3-5-10(6-9)13-2/h3-6,8H,1-2H3/t8-/m0/s1
InChI Key:
YNWCQMWZIOMQOP-QMMMGPOBSA-N
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
177.079g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.203g/mol
Monoisotopic Mass:
177.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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