Home Carboxys Benzyl 3-pyrroline-1-carboxylate

Benzyl 3-pyrroline-1-carboxylate

CAS No.:
31970-04-4
Catalog Number:
AG003O3P
Molecular Formula:
C12H13NO2
Molecular Weight:
203.2371
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$37
- +
5g
98%
In Stock USA
United States
$38
- +
25g
98%
In Stock USA
United States
$113
- +
100g
98%
In Stock USA
United States
$400
- +
Product Description
Catalog Number:
AG003O3P
Chemical Name:
Benzyl 3-pyrroline-1-carboxylate
CAS Number:
31970-04-4
Molecular Formula:
C12H13NO2
Molecular Weight:
203.2371
MDL Number:
MFCD01863559
IUPAC Name:
benzyl 2,5-dihydropyrrole-1-carboxylate
InChI:
InChI=1S/C12H13NO2/c14-12(13-8-4-5-9-13)15-10-11-6-2-1-3-7-11/h1-7H,8-10H2
InChI Key:
XSKKIFJNZPNVGO-UHFFFAOYSA-N
SMILES:
O=C(N1CC=CC1)OCc1ccccc1
EC Number:
608-686-9
Properties
Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.095g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.241g/mol
Monoisotopic Mass:
203.095g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties