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13124-67-9

13124-67-9 | 3,6,6-trimethylbicyclo[3.1.0]hexane-3-carbaldehyde

CAS No: 13124-67-9 Catalog No: AG01C47N MDL No:MFCD24674121

Product Description

Catalog Number:
AG01C47N
Chemical Name:
3,6,6-trimethylbicyclo[3.1.0]hexane-3-carbaldehyde
CAS Number:
13124-67-9
Molecular Formula:
C10H16O
Molecular Weight:
152.2334
MDL Number:
MFCD24674121
IUPAC Name:
3,6,6-trimethylbicyclo[3.1.0]hexane-3-carbaldehyde
InChI:
InChI=1S/C10H16O/c1-9(2)7-4-10(3,6-11)5-8(7)9/h6-8H,4-5H2,1-3H3
InChI Key:
HODJJSXHJFNBQH-UHFFFAOYSA-N
SMILES:
O=CC1(C)CC2C(C1)C2(C)C

Properties

Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.12g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.237g/mol
Monoisotopic Mass:
152.12g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

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