AG000UBB

130369-10-7 | Carbamic acid, [3-(aminomethyl)cyclobutyl]-, 1,1-dimethylethyl ester (9CI)

AG000UBB

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CAS Number	130369-10-7
Catalog Number	AG000UBB(AGN-PC-0WAF6W)
Chemical Name	Carbamic acid, [3-(aminomethyl)cyclobutyl]-, 1,1-dimethylethyl ester (9CI)
IUPAC Name	tert-butyl N-[3-(aminomethyl)cyclobutyl]carbamate
InChI	InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-8-4-7(5-8)6-11/h7-8H,4-6,11H2,1-3H3,(H,12,13)
InChI Key	ACDLXPYQWYTZLE-UHFFFAOYSA-N
MDL Number	MFCD17392592
Molecular Formula	C10H20N2O2
Molecular Weight	200.2780
SMILES	O=C(OC(C)(C)C)NC1CC(CN)C1
Synonyms	130369-10-7, tert-Butyl (3-(aminomethyl)cyclobutyl)carbamate, 1214727-57-7, 871014-28-7, TRANS-TERT-BUTYL (3-(AMINOMETHYL)CYCLOBUTYL)CARBAMATE, CIS-TERT-BUTYL (3-(AMINOMETHYL)CYCLOBUTYL)CARBAMATE, tert-Butyl (trans-3-(aminomethyl)cyclobutyl)carbamate, TERT-BUTYL N-[3-(AMINOMETHYL)CYCLOBUTYL]CARBAMATE, tert-Butyl (cis-3-(aminomethyl)cyclobutyl)carbamate, tert-Butyl 3-(aminomethyl)cyclobutylcarbamate, Carbamic acid, [3-(aminomethyl)cyclobutyl]-, 1,1-dimethylethyl ester (9CI), tert-Butyl [3-(aminomethyl)cyclobutyl]carbamate, CS-WAA0307, SCHEMBL8273073, SCHEMBL9470441, tert-Butyl N-[cis-3-(aminomethyl)cyclobutyl]carbamate, SCHEMBL12578292, SCHEMBL13920524, SCHEMBL16350381, DTXSID90599998, ACDLXPYQWYTZLE-UHFFFAOYSA-N, ACDLXPYQWYTZLE-ZKCHVHJHSA-N, KS-000004WN, PS-J-060, MFCD17392592, MFCD20921511, MFCD22123684, ZINC95626738, AKOS022171614, AKOS025290135, AKOS025290136, ZINC101788110, ZINC101788116, PB11469, PB13769, PB19770, 1-(Boc-amino)cyclobutane-3-methanamine, KS-0000070O, KS-0000070P, AS-34139, AS-34475, AS-34476, AB0159515, AJ-132862, cis-1-(Boc-amino)cyclobutane-3-methanamine, ST1110818, tert-Butyl3-(aminomethyl)cyclobutylcarbamate, CS-0045543, CS-0047952, FT-0687398, trans-1-(Boc-amino)cyclobutane-3-methanamine, Q-4134, Q-4245, Q-4535, tert-butyl[trans-3-(aminomethyl)cyclobutyl]carbamate, 2-Methyl-2-propanyl [3-(aminomethyl)cyclobutyl]carbamate, N-[trans-3-(Aminomethyl)cyclobutyl]carbamic acid 1,1-dimethylethyl ester, CARBAMIC ACID, N-[TRANS-3-(AMINOMETHYL)CYCLOBUTYL]-, 1,1-DIMETHYLETHYL ESTER,

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 statements	H302-H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

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