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1934521-42-2

1934521-42-2 | 2-methyl-1-(3-methylbut-2-en-1-yl)cyclopentane-1-carbaldehyde

CAS No: 1934521-42-2 Catalog No: AG01BTT7 MDL No:

Product Description

Catalog Number:
AG01BTT7
Chemical Name:
2-methyl-1-(3-methylbut-2-en-1-yl)cyclopentane-1-carbaldehyde
CAS Number:
1934521-42-2
Molecular Formula:
C12H20O
Molecular Weight:
180.2866
IUPAC Name:
2-methyl-1-(3-methylbut-2-enyl)cyclopentane-1-carbaldehyde
InChI:
InChI=1S/C12H20O/c1-10(2)6-8-12(9-13)7-4-5-11(12)3/h6,9,11H,4-5,7-8H2,1-3H3
InChI Key:
UQNYYJFBLOWZHX-UHFFFAOYSA-N
SMILES:
O=CC1(CCCC1C)CC=C(C)C

Properties

Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.151g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.291g/mol
Monoisotopic Mass:
180.151g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

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