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84386-03-8 | Cyclopropanecarbonylchloride, 2,2-dimethyl-3-(4-methyl-1,3-pentadien-1-yl)-
CAS No: 84386-03-8 Catalog No: AG004SXA MDL No:
Product Description
Catalog Number:
AG004SXA
Chemical Name:
Cyclopropanecarbonylchloride, 2,2-dimethyl-3-(4-methyl-1,3-pentadien-1-yl)-
CAS Number:
84386-03-8
Molecular Formula:
C12H17ClO
Molecular Weight:
212.7158
IUPAC Name:
2,2-dimethyl-3-(4-methylpenta-1,3-dienyl)cyclopropane-1-carbonyl chloride
InChI:
InChI=1S/C12H17ClO/c1-8(2)6-5-7-9-10(11(13)14)12(9,3)4/h5-7,9-10H,1-4H3
InChI Key:
MZXBQEXYGJRDNU-UHFFFAOYSA-N
SMILES:
CC(=CC=CC1C(C1(C)C)C(=O)Cl)C
Properties
Complexity:
295
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.097g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.717g/mol
Monoisotopic Mass:
212.097g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
1
XLogP3:
4.1
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