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30897-76-8 | Bicyclo[3.1.1]hept-2-ene, 2-(chloromethyl)-6,6-dimethyl-
CAS No: 30897-76-8 Catalog No: AG0031LR MDL No:
Product Description
Catalog Number:
AG0031LR
Chemical Name:
Bicyclo[3.1.1]hept-2-ene, 2-(chloromethyl)-6,6-dimethyl-
CAS Number:
30897-76-8
Molecular Formula:
C10H15Cl
Molecular Weight:
170.6791
IUPAC Name:
2-(chloromethyl)-6,6-dimethylbicyclo[3.1.1]hept-2-ene
InChI:
InChI=1S/C10H15Cl/c1-10(2)8-4-3-7(6-11)9(10)5-8/h3,8-9H,4-6H2,1-2H3
InChI Key:
HJMBBNXCSKYLPS-UHFFFAOYSA-N
SMILES:
ClCC1=CCC2CC1C2(C)C
EC Number:
250-377-2
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.086g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.68g/mol
Monoisotopic Mass:
170.086g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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