AG00774X

1179359-61-5 | 3-N-BOC-3-METHYLBUTANE-1,3-DIAMINE-HCL

AG00774X

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CAS Number	1179359-61-5
Catalog Number	AG00774X(AGN-PC-08YJ1L)
Chemical Name	3-N-BOC-3-METHYLBUTANE-1,3-DIAMINE-HCL
IUPAC Name	tert-butyl N-(4-amino-2-methylbutan-2-yl)carbamate;hydrochloride
InChI	InChI=1S/C10H22N2O2.ClH/c1-9(2,3)14-8(13)12-10(4,5)6-7-11;/h6-7,11H2,1-5H3,(H,12,13);1H
InChI Key	QNVUUFBWGBPXQW-UHFFFAOYSA-N
MDL Number	MFCD12755995
Molecular Formula	C10H23ClN2O2
Molecular Weight	238.7548
SMILES	CC(NC(OC(C)(C)C)=O)(C)CCN.[H]Cl
Synonyms	1179359-61-5, tert-Butyl (4-amino-2-methylbutan-2-yl)carbamate hydrochloride, 3-N-Boc-3-methylbutane-1,3-diamine-HCl, 3-N-Boc-3-Methylbutane-1,3-diamine hydrochloride, AK-42106, CTK8E1464, DTXSID60679635, KS-00000OG1, MFCD12755995, AKOS015846587, CS-W022971, BC688166, DS-14031, 3-N-Boc-3-methylbutane-1,3-diamine HCl, AB0000412, AX8209453, ST2407610, TC-065845, 4CH-016936, FT-0084231, FT-0660209, X9228, B-1830, EN300-174878, tert-Butyl (4-amino-2-methylbutan-2-yl)carbamate HCl, tert-butyl N-(4-amino-2-methylbutan-2-yl)carbamate;hydrochloride, tert-Butyl (4-amino-2-methylbutan-2-yl)carbamate--hydrogen chloride (1/1), C10H23ClN2O2, tert-Butyl(4-amino-2-methylbutan-2-yl)carbamatehydrochloride,

Complexity	195
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	238.145g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	238.756g/mol
Monoisotopic Mass	238.145g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	64.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number