Home Other Building Blocks 2-(1-methylpyrrolidin-3-ylidene)acetic acid hydrochloride

2-(1-methylpyrrolidin-3-ylidene)acetic acid hydrochloride

CAS No.:
1909358-90-2
Catalog Number:
AG01B26R
Molecular Formula:
C7H12ClNO2
Molecular Weight:
177.6287
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Product Description
Catalog Number:
AG01B26R
Chemical Name:
2-(1-methylpyrrolidin-3-ylidene)acetic acid hydrochloride
CAS Number:
1909358-90-2
Molecular Formula:
C7H12ClNO2
Molecular Weight:
177.6287
MDL Number:
MFCD29907332
IUPAC Name:
2-(1-methylpyrrolidin-3-ylidene)acetic acid;hydrochloride
InChI:
InChI=1S/C7H11NO2.ClH/c1-8-3-2-6(5-8)4-7(9)10;/h4H,2-3,5H2,1H3,(H,9,10);1H
InChI Key:
NGBOUWOVCLGJIA-UHFFFAOYSA-N
SMILES:
CN1CCC(=CC(=O)O)C1.Cl
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.056g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
177.628g/mol
Monoisotopic Mass:
177.056g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
Properties