Home Carbonyls Trans-2-phenylcyclopropanecarbonyl chloride

Trans-2-phenylcyclopropanecarbonyl chloride

CAS No.:
939-87-7
Catalog Number:
AG003UWR
Molecular Formula:
C10H9ClO
Molecular Weight:
180.6309
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Product Description
Catalog Number:
AG003UWR
Chemical Name:
Trans-2-phenylcyclopropanecarbonyl chloride
CAS Number:
939-87-7
Molecular Formula:
C10H9ClO
Molecular Weight:
180.6309
MDL Number:
MFCD00001278
IUPAC Name:
(1R,2R)-2-phenylcyclopropane-1-carbonyl chloride
InChI:
InChI=1S/C10H9ClO/c11-10(12)9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6H2/t8-,9+/m0/s1
InChI Key:
SODZBMGDYKEZJG-DTWKUNHWSA-N
SMILES:
ClC(=O)[C@@H]1C[C@H]1c1ccccc1
EC Number:
213-365-8
NSC Number:
80667
Properties
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
180.034g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.631g/mol
Monoisotopic Mass:
180.034g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties