Home Carboxys tert-Butyl 7-formyl-3,4-dihydroisoquinoline-2(1h)-carboxylate

tert-Butyl 7-formyl-3,4-dihydroisoquinoline-2(1h)-carboxylate

CAS No.:
253801-24-0
Catalog Number:
AG00BHR2
Molecular Formula:
C15H19NO3
Molecular Weight:
261.3163
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$357
- +
1g
95%
1 week
United States
$837
- +
Product Description
Catalog Number:
AG00BHR2
Chemical Name:
tert-Butyl 7-formyl-3,4-dihydroisoquinoline-2(1h)-carboxylate
CAS Number:
253801-24-0
Molecular Formula:
C15H19NO3
Molecular Weight:
261.3163
MDL Number:
MFCD10700127
IUPAC Name:
tert-butyl 7-formyl-3,4-dihydro-1H-isoquinoline-2-carboxylate
InChI:
InChI=1S/C15H19NO3/c1-15(2,3)19-14(18)16-7-6-12-5-4-11(10-17)8-13(12)9-16/h4-5,8,10H,6-7,9H2,1-3H3
InChI Key:
RGDRYXCSOMYMKK-UHFFFAOYSA-N
SMILES:
O=Cc1ccc2c(c1)CN(CC2)C(=O)OC(C)(C)C
Properties
Complexity:
348  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.136g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.321g/mol
Monoisotopic Mass:
261.136g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties