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2498-46-6 | Benzeneethanimidamide, hydrochloride (1:1)
CAS No: 2498-46-6 Catalog No: AG002Q2U MDL No:MFCD06761717
Product Description
Catalog Number:
AG002Q2U
Chemical Name:
Benzeneethanimidamide, hydrochloride (1:1)
CAS Number:
2498-46-6
Molecular Formula:
C8H11ClN2
Molecular Weight:
170.6393
MDL Number:
MFCD06761717
IUPAC Name:
2-phenylethanimidamide;hydrochloride
InChI:
InChI=1S/C8H10N2.ClH/c9-8(10)6-7-4-2-1-3-5-7;/h1-5H,6H2,(H3,9,10);1H
InChI Key:
UBSBLGBWNYUPDW-UHFFFAOYSA-N
SMILES:
NC(=N)Cc1ccccc1.Cl
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.061g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
170.64g/mol
Monoisotopic Mass:
170.061g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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