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1261105-30-9 | Benzoic acid, 5-chloro-2-hydrazinyl-, methyl ester
CAS No: 1261105-30-9 Catalog No: AG000RN3 MDL No:MFCD10566263
Product Description
Catalog Number:
AG000RN3
Chemical Name:
Benzoic acid, 5-chloro-2-hydrazinyl-, methyl ester
CAS Number:
1261105-30-9
Molecular Formula:
C8H9ClN2O2
Molecular Weight:
200.6223
MDL Number:
MFCD10566263
IUPAC Name:
methyl 5-chloro-2-hydrazinylbenzoate
InChI:
InChI=1S/C8H9ClN2O2/c1-13-8(12)6-4-5(9)2-3-7(6)11-10/h2-4,11H,10H2,1H3
InChI Key:
YRPZNGGYOQNFHI-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(Cl)ccc1NN
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.035g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
200.622g/mol
Monoisotopic Mass:
200.035g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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