Home Halogens 2-[(cyclopropylmethyl)amino]-2-(3,5-dichlorophenyl)acetic acid hydrochloride

2-[(cyclopropylmethyl)amino]-2-(3,5-dichlorophenyl)acetic acid hydrochloride

CAS No.:
1423025-21-1
Catalog Number:
AG01A1N4
Molecular Formula:
C12H14Cl3NO2
Molecular Weight:
310.6041
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Product Description
Catalog Number:
AG01A1N4
Chemical Name:
2-[(cyclopropylmethyl)amino]-2-(3,5-dichlorophenyl)acetic acid hydrochloride
CAS Number:
1423025-21-1
Molecular Formula:
C12H14Cl3NO2
Molecular Weight:
310.6041
MDL Number:
MFCD22565881
IUPAC Name:
2-(cyclopropylmethylamino)-2-(3,5-dichlorophenyl)acetic acid;hydrochloride
InChI:
InChI=1S/C12H13Cl2NO2.ClH/c13-9-3-8(4-10(14)5-9)11(12(16)17)15-6-7-1-2-7;/h3-5,7,11,15H,1-2,6H2,(H,16,17);1H
InChI Key:
GNUFBLQKHWYIAA-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1cc(Cl)cc(c1)Cl)NCC1CC1.Cl
Properties
Complexity:
274  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.009g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
310.599g/mol
Monoisotopic Mass:
309.009g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties