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CAS No.: | 2498-47-7 |
---|---|
Name: | cyclohexylguanidine monohydrochloride |
Article Data: | 8 |
Molecular Structure: | |
Formula: | C7H16ClN3 |
Molecular Weight: | 177.677 |
Synonyms: | Guanidine,cyclohexyl-, hydrochloride (6CI,7CI);Guanidine, cyclohexyl-, monohydrochloride(8CI,9CI);Cyclohexylguanidine hydrochloride; |
EINECS: | 219-691-7 |
Melting Point: | 224-226 °C |
Boiling Point: | 279oC at 760mmHg |
Flash Point: | 122.6oC |
Hazard Symbols: | Xn |
Risk Codes: | 22 |
PSA: | 61.90000 |
LogP: | 2.79510 |
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The Guanidine,N-cyclohexyl-, hydrochloride (1:1), with the CAS registry number 2498-47-7, is also known as N-cyclohexylguanidine hydrochloride. It belongs to the product category of Ring Systems. Its EINECS registry number is 219-691-7. This chemical's molecular formula is C7H16ClN3 and molecular weight is 177.67504. Its IUPAC name is called 2-cyclohexylguanidine hydrochloride.
Physical properties of Guanidine,N-cyclohexyl-, hydrochloride (1:1): (1)H-Bond Donor: 3; (2)H-Bond Acceptor: 3; (3)Rotatable Bond Count: 1; (4)Tautomer Count: 2; (5)Exact Mass: 177.103275; (6)MonoIsotopic Mass: 177.103275; (7)Topological Polar Surface Area: 64.4; (8)Heavy Atom Count: 11; (9)Formal Charge: 0; (10)Complexity: 121; (11)Covalently-Bonded Unit Count: 2.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1CCC(CC1)N=C(N)N.Cl
(2)InChI: InChI=1S/C7H15N3.ClH/c8-7(9)10-6-4-2-1-3-5-6;/h6H,1-5H2,(H4,8,9,10);1H
(3)InChIKey: RYNCIRCAXCMTCY-UHFFFAOYSA-N