Home Halogens Methyl 2-chloro-7h-pyrrolo[2,3-d]pyrimidine-5-carboxylate

Methyl 2-chloro-7h-pyrrolo[2,3-d]pyrimidine-5-carboxylate

CAS No.:
1352396-67-8
Catalog Number:
AG00HTZ3
Molecular Formula:
C8H6ClN3O2
Molecular Weight:
211.6051
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
1 week
United States
$523
- +
5g
97%
1 week
United States
$1492
- +
10g
97%
1 week
United States
$2463
- +
Product Description
Catalog Number:
AG00HTZ3
Chemical Name:
Methyl 2-chloro-7h-pyrrolo[2,3-d]pyrimidine-5-carboxylate
CAS Number:
1352396-67-8
Molecular Formula:
C8H6ClN3O2
Molecular Weight:
211.6051
MDL Number:
MFCD20923472
IUPAC Name:
methyl 2-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate
InChI:
InChI=1S/C8H6ClN3O2/c1-14-7(13)5-3-10-6-4(5)2-11-8(9)12-6/h2-3H,1H3,(H,10,11,12)
InChI Key:
PERSMPFYDSKYFP-UHFFFAOYSA-N
SMILES:
COC(=O)c1c[nH]c2c1cnc(n2)Cl
Properties
Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.015g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
211.605g/mol
Monoisotopic Mass:
211.015g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
67.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties