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1570-86-1 | Cyclopropanecarbonyl chloride, 1-[(4-methylphenyl)methyl]-
CAS No: 1570-86-1 Catalog No: AG001P5S MDL No:MFCD27945480
Product Description
Catalog Number:
AG001P5S
Chemical Name:
Cyclopropanecarbonyl chloride, 1-[(4-methylphenyl)methyl]-
CAS Number:
1570-86-1
Molecular Formula:
C12H13ClO
Molecular Weight:
208.6840
MDL Number:
MFCD27945480
IUPAC Name:
1-[(4-methylphenyl)methyl]cyclopropane-1-carbonyl chloride
InChI:
InChI=1S/C12H13ClO/c1-9-2-4-10(5-3-9)8-12(6-7-12)11(13)14/h2-5H,6-8H2,1H3
InChI Key:
JNOQIWROIDIHDU-UHFFFAOYSA-N
SMILES:
ClC(=O)C1(CC1)Cc1ccc(cc1)C
EC Number:
216-383-4
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.065g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.685g/mol
Monoisotopic Mass:
208.065g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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