Home Other Building Blocks 1-Methylcycloheptanol

1-Methylcycloheptanol

CAS No.:
3761-94-2
Catalog Number:
AG003HP1
Molecular Formula:
C8H16O
Molecular Weight:
128.2120
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Product Description
Catalog Number:
AG003HP1
Chemical Name:
1-Methylcycloheptanol
CAS Number:
3761-94-2
Molecular Formula:
C8H16O
Molecular Weight:
128.2120
MDL Number:
MFCD00021672
IUPAC Name:
1-methylcycloheptan-1-ol
InChI:
InChI=1S/C8H16O/c1-8(9)6-4-2-3-5-7-8/h9H,2-7H2,1H3
InChI Key:
XFFKAYOHINCUNU-UHFFFAOYSA-N
SMILES:
CC1(O)CCCCCC1
EC Number:
223-179-9
NSC Number:
100735
Properties
Complexity:
80.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.12g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
128.215g/mol
Monoisotopic Mass:
128.12g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties