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119056-07-4 | Benzenemethanol, 2-chloro-5-(dimethylamino)-
CAS No: 119056-07-4 Catalog No: AG000I4Q MDL No:
Product Description
Catalog Number:
AG000I4Q
Chemical Name:
Benzenemethanol, 2-chloro-5-(dimethylamino)-
CAS Number:
119056-07-4
Molecular Formula:
C9H12ClNO
Molecular Weight:
185.6507
IUPAC Name:
[2-chloro-5-(dimethylamino)phenyl]methanol
InChI:
InChI=1S/C9H12ClNO/c1-11(2)8-3-4-9(10)7(5-8)6-12/h3-5,12H,6H2,1-2H3
InChI Key:
KSYAUZQKSOIOBW-UHFFFAOYSA-N
SMILES:
OCc1cc(ccc1Cl)N(C)C
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.061g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
185.651g/mol
Monoisotopic Mass:
185.061g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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