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3073-92-5

3073-92-5 | Butane, 1-propoxy-

CAS No: 3073-92-5 Catalog No: AG00313D MDL No:

Product Description

Catalog Number:
AG00313D
Chemical Name:
Butane, 1-propoxy-
CAS Number:
3073-92-5
Molecular Formula:
C7H16O
Molecular Weight:
116.2013
IUPAC Name:
1-propoxybutane
InChI:
InChI=1S/C7H16O/c1-3-5-7-8-6-4-2/h3-7H2,1-2H3
InChI Key:
YGZQJYIITOMTMD-UHFFFAOYSA-N
SMILES:
CCCOCCCC

Properties

Complexity:
35.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
116.12g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
116.204g/mol
Monoisotopic Mass:
116.12g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

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