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2-[(2-chloroacetyl)amino]-3-methylbutanoic acid

Catalog No: FT-0712345

CAS No: 4090-17-9

Chemical Name: 2-[(2-chloroacetyl)amino]-3-methylbutanoic acid
Molecular Formula: C7H12ClNO3
Molecular Weight: 193.63
InChI Key: LJRISAYPKJORFZ-UHFFFAOYSA-N
InChI: InChI=1S/C7H12ClNO3/c1-4(2)6(7(11)12)9-5(10)3-8/h4,6H,3H2,1-2H3,(H,9,10)(H,11,12)

Product pricing and availability information
Assay	Pack Size	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

FW:	193.62800
CAS:	4090-17-9
Flash_Point:	N/A
MF:	C7H12ClNO3
Symbol:	Warning
Bolling_Point:	N/A
Melting_Point:	130ºC
Product_Name:	2-[(2-chloroacetyl)amino]-3-methylbutanoic acid
Density:	N/A

FW:	193.62800
MF:	C7H12ClNO3
Computational_Chemistry:	['1. XlogP :11 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :2 ', '6. TPSA 664 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :182 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :1 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
LogP:	1.29090
Melting_Point:	130ºC
Exact_Mass:	193.05100
PSA:	69.89000

Personal_Protective_Equipment:	dust mask type N95 (US);Eyeshields;Gloves
Symbol:	GHS07
Safety_Statements:	26-36
RIDADR:	NONH for all modes of transport
Risk_Statements(EU):	36/37/38
Hazard_Codes:	Xi
Warning_Statement:	P261-P305 + P351 + P338
HS_Code:	2924199090