Home Other Building Blocks 4-Chloro-N-(cyclopropylmethyl)aniline

4-Chloro-N-(cyclopropylmethyl)aniline

CAS No.:
69565-54-4
Catalog Number:
AG003406
Molecular Formula:
C10H12ClN
Molecular Weight:
181.6620
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Product Description
Catalog Number:
AG003406
Chemical Name:
4-Chloro-N-(cyclopropylmethyl)aniline
CAS Number:
69565-54-4
Molecular Formula:
C10H12ClN
Molecular Weight:
181.6620
MDL Number:
MFCD03211296
IUPAC Name:
4-chloro-N-(cyclopropylmethyl)aniline
InChI:
InChI=1S/C10H12ClN/c11-9-3-5-10(6-4-9)12-7-8-1-2-8/h3-6,8,12H,1-2,7H2
InChI Key:
WFMRFDUZTOOYKV-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)NCC1CC1
Properties
Complexity:
137  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.066g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
181.663g/mol
Monoisotopic Mass:
181.066g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties