3-Bromobenzamidine Hydrochloride - CAS 16796-52-4
Catalog: |
BB012441 |
Product Name: |
3-Bromobenzamidine Hydrochloride |
CAS: |
16796-52-4 |
Synonyms: |
3-bromobenzenecarboximidamide;hydrochloride; 3-bromobenzenecarboximidamide;hydrochloride |
IUPAC Name: | 3-bromobenzenecarboximidamide;hydrochloride |
Description: | 3-Bromobenzamidine Hydrochloride (CAS# 16796-52-4) is a useful research chemical. |
Molecular Weight: | 235.51 |
Molecular Formula: | C7H8BrClN2 |
Canonical SMILES: | C1=CC(=CC(=C1)Br)C(=N)N.Cl |
InChI: | InChI=1S/C7H7BrN2.ClH/c8-6-3-1-2-5(4-6)7(9)10;/h1-4H,(H3,9,10);1H |
InChI Key: | XIZFRYIWRFNILW-UHFFFAOYSA-N |
Boiling Point: | 307.3 °C at 760 mmHg |
MDL: | MFCD04114439 |
LogP: | 3.33520 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113480486-A | 3-amido-1, 2,4-triazole derivative and preparation method and application thereof | 20210730 |
KR-20200118387-A | Condensed cyclic compound and organic light emitting device including the same | 20200928 |
KR-20200118388-A | Condensed cyclic compound and organic light emitting device including the same | 20200928 |
WO-2021185256-A1 | Substituted pyrimidine or pyridine amine derivative, composition thereof, and medical use thereof | 20200316 |
KR-20200018551-A | Condensed cyclic compound and organic light emitting device including the same | 20200212 |
Complexity: | 136 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 233.95594 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 233.95594 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 49.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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