Home Aldehydes Benzaldehyde, 3-propyl- (9CI)

Benzaldehyde, 3-propyl- (9CI)

CAS No.:
103528-31-0
Catalog Number:
AG0098AA
Molecular Formula:
C10H12O
Molecular Weight:
148.2017
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Product Description
Catalog Number:
AG0098AA
Chemical Name:
Benzaldehyde, 3-propyl- (9CI)
CAS Number:
103528-31-0
Molecular Formula:
C10H12O
Molecular Weight:
148.2017
MDL Number:
MFCD18824427
IUPAC Name:
3-propylbenzaldehyde
InChI:
InChI=1S/C10H12O/c1-2-4-9-5-3-6-10(7-9)8-11/h3,5-8H,2,4H2,1H3
InChI Key:
FDKRXGOMMRLUIQ-UHFFFAOYSA-N
SMILES:
CCCc1cccc(c1)C=O
Properties
Complexity:
120  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.089g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.205g/mol
Monoisotopic Mass:
148.089g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties