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29119-58-2 | Carbonimidic dichloride, (1-methylethyl)- (9CI)
CAS No: 29119-58-2 Catalog No: AG002XDS MDL No:
Product Description
Catalog Number:
AG002XDS
Chemical Name:
Carbonimidic dichloride, (1-methylethyl)- (9CI)
CAS Number:
29119-58-2
Molecular Formula:
C4H7Cl2N
Molecular Weight:
140.0111
IUPAC Name:
1,1-dichloro-N-propan-2-ylmethanimine
InChI:
InChI=1S/C4H7Cl2N/c1-3(2)7-4(5)6/h3H,1-2H3
InChI Key:
CYISMMUFVOUBEN-UHFFFAOYSA-N
SMILES:
CC(N=C(Cl)Cl)C
Properties
Complexity:
73.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.996g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
140.007g/mol
Monoisotopic Mass:
138.996g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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