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65703-76-6 | Acetaldehyde, chloro-, hydrate
CAS No: 65703-76-6 Catalog No: AG006POX MDL No:
Product Description
Catalog Number:
AG006POX
Chemical Name:
Acetaldehyde, chloro-, hydrate
CAS Number:
65703-76-6
Molecular Formula:
C2H5ClO2
Molecular Weight:
96.5129
IUPAC Name:
2-chloroacetaldehyde;hydrate
InChI:
InChI=1S/C2H3ClO.H2O/c3-1-2-4;/h2H,1H2;1H2
InChI Key:
SUQCVWYRTYMULT-UHFFFAOYSA-N
SMILES:
ClCC=O.O
Properties
Complexity:
20
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
95.998g/mol
Formal Charge:
0
Heavy Atom Count:
5
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
96.51g/mol
Monoisotopic Mass:
95.998g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
18.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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