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3,5-Dichlorophenyl Isocyanate

Catalog Number
ACM34893920
Product Name
3,5-Dichlorophenyl Isocyanate
Structure
CAS
34893-92-0
Category
Dendrimer Building Blocks
IUPAC Name
1,3-dichloro-5-isocyanatobenzene
Molecular Weight
188.01g/mol
Molecular Formula
C7H3Cl2NO
Canonical SMILES
C1=C(C=C(C=C1Cl)Cl)N=C=O
InChI
InChI=1S/C7H3Cl2NO/c8-5-1-6(9)3-7(2-5)10-4-11/h1-3H
InChI Key
XEFUJGURFLOFAN-UHFFFAOYSA-N
Complexity
169
Covalently-Bonded Unit Count
1
EC Number
252-276-9
Exact Mass
186.959169g/mol
Formal Charge
0
Heavy Atom Count
11
Monoisotopic Mass
186.959169g/mol
Rotatable Bond Count
1
XLogP3
4
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