sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks 2-Decalone

2-Decalone

CAS No.:
4832-17-1
Catalog Number:
AG003H56
Molecular Formula:
C10H16O
Molecular Weight:
152.2334
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
1 week
United States
$80
- +
5g
98%
1 week
United States
$121
- +
Product Description
Catalog Number:
AG003H56
Chemical Name:
2-Decalone
CAS Number:
4832-17-1
Molecular Formula:
C10H16O
Molecular Weight:
152.2334
MDL Number:
MFCD00001731
IUPAC Name:
3,4,4a,5,6,7,8,8a-octahydro-1H-naphthalen-2-one
InChI:
InChI=1S/C10H16O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h8-9H,1-7H2
InChI Key:
LGVJRKCQQHOWAU-UHFFFAOYSA-N
SMILES:
O=C1CCC2C(C1)CCCC2
EC Number:
216-422-5
NSC Number:
289484
Properties
Complexity:
162  
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:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Literature
Title Journal
14-Hy-droxy-8,14-secogammacera-7-ene-3,21-dione from the bark of Lansium domesticum Corr. Acta crystallographica. Section E, Structure reports online 20100701
Aerobic biotransformation of decalin (decahydronaphthalene) by Rhodococcus spp. Biodegradation 20081101
(4aS,5R,7R,8S,8aR)-8-(1,3-Dioxolan-2-yl)-7,8-dimethyl-5-(1-methyl-ethen-yl)perhydro-naphthalen-2-one. Acta crystallographica. Section E, Structure reports online 20080101
Alpha 2u-globulin nephropathy and carcinogenicity following exposure to decalin (decahydronaphthalene) in F344/N rats. Toxicological sciences : an official journal of the Society of Toxicology 20030401
Properties