CAS
2113-47-5 Purity
96%
2113-47-5 Purity
96%
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1-(3-Chlorophenyl)biguanide hydrochloride
CAS
2113-05-5
Catalog Number
ACM2113055
Category
Other Products
Molecular Weight
248.11
Molecular Formula
C8H12ClN5+2
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Specification
Synonyms
1-(m-Chlorophenyl)biguanide hydrochloride, N-(3-Chlorophenyl)imidodicarbonimidic diamide hydrochloride, m-CPBG hydrochloride
IUPAC Name
[amino(diaminomethylideneazaniumyl)methylidene]-(3-chlorophenyl)azanium
Canonical SMILES
C1=CC(=CC(=C1)Cl)N=C(N)N=C(N)N.Cl
InChI Key
DIHXJZHAIHGSAW-UHFFFAOYSA-P
Boiling Point
434.1ºC at 760mmHg
Melting Point
190-194ºC(lit.)
Flash Point
216.3ºC
Density
1.49g/cm³
Exact Mass
247.03900
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
3
H-Bond Donor
5
Safety Description
26-36
WGK Germany
3
Upstream Synthesis Route 1
- 127099-85-8
- 108-42-9
- 2113-05-5
Reference: [1] Bioorganic and Medicinal Chemistry Letters, 2009, vol. 19, # 19, p. 5644 - 5647
Downstream Synthesis Route 1
- 2113-05-5
- 52632-39-0
- 108-42-9
Reference: [1]Journal of the American Chemical Society,1959,vol. 81,p. 3725,3726
* For details of the synthesis route, please refer to the original source to ensure accuracy.
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