AG000DLK

1170390-54-1 | 1,4-Oxazepine-4(5H)-carboxylic acid, 6-aminotetrahydro-, 1,1-dimethylethyl ester

AG000DLK

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	1170390-54-1
Catalog Number	AG000DLK(AGN-PC-07134F)
Chemical Name	1,4-Oxazepine-4(5H)-carboxylic acid, 6-aminotetrahydro-, 1,1-dimethylethyl ester
IUPAC Name	tert-butyl 6-amino-1,4-oxazepane-4-carboxylate
InChI	InChI=1S/C10H20N2O3/c1-10(2,3)15-9(13)12-4-5-14-7-8(11)6-12/h8H,4-7,11H2,1-3H3
InChI Key	QIAURBVQLIUTQH-UHFFFAOYSA-N
MDL Number	MFCD12964084
Molecular Formula	C10H20N2O3
Molecular Weight	216.2774
SMILES	O=C(N1CCOCC(N)C1)OC(C)(C)C
Synonyms	1170390-54-1, 4-Boc-6-Amino-1,4-oxazepane, TERT-BUTYL 6-AMINO-1,4-OXAZEPANE-4-CARBOXYLATE, 4-Boc-6-Amino-[1,4]oxazepane, SCHEMBL1441257, CTK8C4675, DTXSID30657102, QIAURBVQLIUTQH-UHFFFAOYSA-N, ANW-72698, MFCD12964084, AKOS016007643, NE63699, RP26978, KS-000019O1, AS-40764, DB-060950, TC-161443, FT-0707643, ST24050058, Y5066, J-514520, 1,4-Oxazepine-4(5H)-carboxylic acid, 6-aminotetrahydro-, 1,1-dimethylethyl ester, C10H20N2O3,

Complexity	225
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	216.147g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	216.281g/mol
Monoisotopic Mass	216.147g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	64.8A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	-0.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H227-H315-H319-H335
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

Lot Number