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88725-10-4 | 2-Propanol, 2-chloro-
CAS No: 88725-10-4 Catalog No: AG0045MX MDL No:
Product Description
Catalog Number:
AG0045MX
Chemical Name:
2-Propanol, 2-chloro-
CAS Number:
88725-10-4
Molecular Formula:
C3H7ClO
Molecular Weight:
94.5401
IUPAC Name:
2-chloropropan-2-ol
InChI:
InChI=1S/C3H7ClO/c1-3(2,4)5/h5H,1-2H3
InChI Key:
IRCMREIFELHNEP-UHFFFAOYSA-N
SMILES:
CC(Cl)(O)C
Properties
Complexity:
33.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
94.019g/mol
Formal Charge:
0
Heavy Atom Count:
5
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
94.538g/mol
Monoisotopic Mass:
94.019g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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