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1563860-65-0 | 3-chloro-3-cyclopropylprop-2-enoic acid
CAS No: 1563860-65-0 Catalog No: AG01FN4F MDL No:MFCD24135495
Product Description
Catalog Number:
AG01FN4F
Chemical Name:
3-chloro-3-cyclopropylprop-2-enoic acid
CAS Number:
1563860-65-0
Molecular Formula:
C6H7ClO2
Molecular Weight:
146.5716
MDL Number:
MFCD24135495
IUPAC Name:
(E)-3-chloro-3-cyclopropylprop-2-enoic acid
InChI:
InChI=1S/C6H7ClO2/c7-5(3-6(8)9)4-1-2-4/h3-4H,1-2H2,(H,8,9)/b5-3+
InChI Key:
YYSKDSYNQGEULQ-HWKANZROSA-N
SMILES:
Cl/C(=C/C(=O)O)/C1CC1
Properties
Complexity:
158
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
146.013g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
146.57g/mol
Monoisotopic Mass:
146.013g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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