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Home > Bromides > 2138033-07-3
2138033-07-3 | 4-bromo-2-chloro-N-propylaniline hydrochloride
CAS No: 2138033-07-3 Catalog No: AG01EL53 MDL No:MFCD31558652
Product Description
Catalog Number:
AG01EL53
Chemical Name:
4-bromo-2-chloro-N-propylaniline hydrochloride
CAS Number:
2138033-07-3
Molecular Formula:
C9H12BrCl2N
Molecular Weight:
285.0083
MDL Number:
MFCD31558652
IUPAC Name:
4-bromo-2-chloro-N-propylaniline;hydrochloride
InChI:
InChI=1S/C9H11BrClN.ClH/c1-2-5-12-9-4-3-7(10)6-8(9)11;/h3-4,6,12H,2,5H2,1H3;1H
InChI Key:
UHASZFHZPSCOKS-UHFFFAOYSA-N
SMILES:
CCCNc1ccc(cc1Cl)Br.Cl
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.953g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
285.006g/mol
Monoisotopic Mass:
282.953g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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