CAS No.22260-51-1,Bromocriptine mesylate Suppliers

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Basic Information

Molecular Structure:
CAS No.:	22260-51-1
Name:	Bromocriptine mesylate
Article Data:	1

Formula:	C₃₂H₄₀BrN₅O₅^.CH₄SO₃
Molecular Weight:	750.711
Synonyms:	Bromocriptine mesilate (JP14);Bromocriptine mesylate (USP);Bromergon;Parlodel (TN);Pravidel;Prestwick_771;Ergotaman-3,6,18-trione, 2-bromo-12-hydroxy-2-(1-methylethyl)-5- (2-methylpropyl)-, (5alpha)-;2-Bromo-alpha-ergocryptine methanesulfonate;Bromocryptine mesylate;Parlodel;CB 154;Ergotaman-3',6',18-trione,2-bromo-12'- hydroxy-2'-(1-methylethyl)-5'-(2-methylpropyl)-,(5'R)-,monomethanesulfonate (salt);Bagren;
EINECS:	244-881-1
Melting Point:	192-196° (dec)
Boiling Point:	891.3 °C at 760 mmHg
Flash Point:	492.8 °C
Solubility:	H₂O: 0.8 mg/mL
Appearance:	white solid
Hazard Symbols:	Xn
Risk Codes:	20/21/22
Safety:	22-24/25-36
PSA:	180.96000
LogP:	3.98220

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Chemistry

Product Name: Bromocriptine mesylate (CAS NO.22260-51-1)

Molecular Formula: C₃₃H₄₄BrN₅O₈S
Molar mass: 750.7 g/mol
EINECS: 244-881-1
Flash Point: 492.8 °C
Boiling Point: 891.3 °C at 760 mmHg
Vapour Pressure: 4.15E^-34mmHg at 25°C
Storage temp: 2-8°C
Solubility: H₂O: 0.8 mg/mL
Form: solid
Color: white
H-Bond Donor: 4
H-Bond Acceptor: 9
Structure Descriptors of Bromocriptine mesylate (CAS NO.22260-51-1):
Canonical SMILES: CC(C)CC1C(=O)N2CCCC2C3(N1C(=O)C(O3)(C(C)C)NC(=O)C4CN(C5CC6=(NC7=CC=CC(=C67)C5=C4)Br)C)O.CS(=O)(=O)O
Isomeric SMILES: CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]3(N1C(=O)[C@](O3)(C(C)C)NC(=O)[C@H]4CN([C@@H]5CC6=C(NC7=CC=CC(=C67)C5=C4)Br)C)O.CS(=O)(=O)O
InChI: InChI=1S/C32H40BrN5O5.CH4O3S/c1-16(2)12-24-29(40)37-11-7-10-25(37)32(42)38(24)30(41)31(43-32,17(3)4)35-28(39)18-13-20-19-8-6-9-22-26(19)21(27(33)34-22)14-23(20)36(5)15-18;1-5(2,3)4/h6,8-9,13,16-18,23-25,34,42H,7,10-12,14-15H2,1-5H3,(H,35,39);1H3,(H,2,3,4)/t18-,23-,24+,25+,31-,32+;/m1./s1
InChIKey: NOJMTMIRQRDZMT-GSPXQYRGSA-N
Product categories: Dopamine receptor

Toxicity Data With Reference

1.	orl-wmn TDLo:650 µg/kg/9D-I:BAH,CVS	AIMEAS Annals of Internal Medicine. 118 (1993),199.
2.	orl-cld TDLo:375 µg/kg	JOPDAB Journal of Pediatrics. 105 (1984),838.
3.	orl-wmn TDLo:1 mg/kg/20D-I:BAH	AJPSAO American Journal of Psychiatry. 143 (1985),935.
4.	orl-man TDLo:52 mg/kg/35W-I:CNS	NEURAI Neurology. 35 (1985),1193.
5.	ivn-rat LD50:10,500 µg/kg	YKYUA6 Yakkyoku. Pharmacy. 29 (1978),1231.
6.	orl-mus LD50:2502 mg/kg	YKYUA6 Yakkyoku. Pharmacy. 30 (1979),809.
7.	ivn-mus LD50:189 mg/kg	YKYUA6 Yakkyoku. Pharmacy. 30 (1979),809.
8.	ivn-rbt LD50:8200 µg/kg	IYKEDH Iyakuhin Kenkyu. Study of Medical Supplies. 10 (1979),232.

Safety Profile

Poison by intravenous route. Moderately toxic by ingestion. Human systemic effects by ingestion: cardiomyopathy. cerebral spinal fluid changes, distorted perceptions, hallucinations, headache, toxic psychosis. An experimental teratogen. Other experimental reproductive effects. When heated to decomposition it emits toxic fumes of Br⁻, SO_x, and NO_x.
Safety Information of Bromocriptine mesylate (CAS NO.22260-51-1):

Hazard Codes: Xn
Risk Statements:
20: Harmful by inhalation
21: Harmful in contact with skin
22: Harmful if swallowed
Safety Statements:
22: Do not breathe dust
24: Avoid contact with skin
25: Avoid contact with eyes
36: Wear suitable protective clothing

Specification

Bromocriptine mesylate (CAS NO.22260-51-1) also can be called Parlodel ; 2-Bromine-a-ergocryptine Methanesulfonate ; 8,9-hexahydroindolo[4,3-fg]quinoléine-9-carboxamide (1:1) ; 2-Bromo-12'-hydroxy-5'a-isobutyl-2'-isopropylergotaman-3',6',18-trione Monomethanesulphonate .