AG0011NT

1363380-57-7 | Carbamic acid, N-[(trans-3-aminocyclobutyl)methyl]-, 1,1-dimethylethyl ester

AG0011NT

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CAS Number	1363380-57-7
Catalog Number	AG0011NT(AGN-PC-0WCKSP)
Chemical Name	Carbamic acid, N-[(trans-3-aminocyclobutyl)methyl]-, 1,1-dimethylethyl ester
IUPAC Name	tert-butyl N-[(3-aminocyclobutyl)methyl]carbamate
InChI	InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-6-7-4-8(11)5-7/h7-8H,4-6,11H2,1-3H3,(H,12,13)
InChI Key	OVVBOBKSGLYQRG-UHFFFAOYSA-N
MDL Number	MFCD22396953
Molecular Formula	C10H20N2O2
Molecular Weight	200.2780
SMILES	CC(C)(C)OC(=O)NC[C@H]1C[C@H](N)C1
Synonyms	CIS-3-(BOC-AMINOMETHYL)CYCLOBUTYLAMINE, 1363380-57-7, 1334499-53-4, tert-butyl N-[(3-aminocyclobutyl)methyl]carbamate, tert-Butyl ((3-aminocyclobutyl)methyl)carbamate, tert-Butyl ((trans-3-aminocyclobutyl)methyl)carbamate, OVVBOBKSGLYQRG-ZKCHVHJHSA-N, MFCD20232875, MFCD22394184, MFCD22396953, ZINC72208878, AKOS015347918, AKOS025403536, AKOS027324291, ZINC103533387, ZINC103538983, NE52969, SB15445, KS-0000070Q, AS-51633, AS-51637, CS-0047813, CS-0049732, Q-4647, Q-4648, tert-butylN-[(3-aminocyclobutyl)methyl]carbamate, tert-butyl(trans-3-aminocyclobutyl)methylcarbamate, tert-butyl (trans-3-aminocyclobutyl)methylcarbamate, Carbamic acid, N-[(trans-3-aminocyclobutyl)methyl]-, 1,1-dimethylethyl ester, TRANS-3-(BOC-AMINOMETHYL)CYCLOBUTYLAMINE, 1363381-81-0,

Complexity	205
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	200.152g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	200.282g/mol
Monoisotopic Mass	200.152g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	64.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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