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23530-82-7 | Benzenemethanamine, N-2-propen-1-yl-, hydrochloride (1:1)
CAS No: 23530-82-7 Catalog No: AG002NLD MDL No:MFCD07107801
Product Description
Catalog Number:
AG002NLD
Chemical Name:
Benzenemethanamine, N-2-propen-1-yl-, hydrochloride (1:1)
CAS Number:
23530-82-7
Molecular Formula:
C10H14ClN
Molecular Weight:
183.6779
MDL Number:
MFCD07107801
IUPAC Name:
N-benzylprop-2-en-1-amine;hydrochloride
InChI:
InChI=1S/C10H13N.ClH/c1-2-8-11-9-10-6-4-3-5-7-10;/h2-7,11H,1,8-9H2;1H
InChI Key:
OUDLNGVMJGSNIV-UHFFFAOYSA-N
SMILES:
C=CCNCc1ccccc1.Cl
Properties
Complexity:
103
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.081g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
183.679g/mol
Monoisotopic Mass:
183.081g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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