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770-70-7 | 1-(CHLOROMETHYL)ADAMANTANE
CAS No: 770-70-7 Catalog No: AG00571E MDL No:
Product Description
Catalog Number:
AG00571E
Chemical Name:
1-(CHLOROMETHYL)ADAMANTANE
CAS Number:
770-70-7
Molecular Formula:
C11H17Cl
Molecular Weight:
184.7057
IUPAC Name:
1-(chloromethyl)adamantane
InChI:
InChI=1S/C11H17Cl/c12-7-11-4-8-1-9(5-11)3-10(2-8)6-11/h8-10H,1-7H2
InChI Key:
VZUOFLCVOCPUCM-UHFFFAOYSA-N
SMILES:
ClCC12CC3CC(C2)CC(C1)C3
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.102g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.707g/mol
Monoisotopic Mass:
184.102g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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