AG001ERN

147291-66-5 | Carbamic acid, N-[(3-aminophenyl)methyl]-, 1,1-dimethylethyl ester

AG001ERN

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CAS Number	147291-66-5
Catalog Number	AG001ERN(AGN-PC-0NAD17)
Chemical Name	Carbamic acid, N-[(3-aminophenyl)methyl]-, 1,1-dimethylethyl ester
IUPAC Name	tert-butyl N-[(3-aminophenyl)methyl]carbamate
InChI	InChI=1S/C12H18N2O2/c1-12(2,3)16-11(15)14-8-9-5-4-6-10(13)7-9/h4-7H,8,13H2,1-3H3,(H,14,15)
InChI Key	LSOZALWRNWQPLK-UHFFFAOYSA-N
MDL Number	MFCD04974010
Molecular Formula	C12H18N2O2
Molecular Weight	222.2835
SMILES	O=C(OC(C)(C)C)NCC1=CC=CC(N)=C1
Synonyms	tert-Butyl 3-aminobenzylcarbamate, 147291-66-5, Tert-butyl N-[(3-aminophenyl)methyl]carbamate, tert-Butyl3-aminobenzylcarbamate, (3-Aminobenzyl)carbamic acid tert-butyl ester, tert-butyl (3-aminobenzyl)carbamate, tert-butyl (3-aminophenyl)methylcarbamate, Carbamic acid, N-[(3-aminophenyl)methyl]-, 1,1-dimethylethyl ester, (3-AMINO-BENZYL)-CARBAMIC ACID TERT-BUTYL ESTER, Carbamic acid,N-[(3-aminophenyl)methyl]-, 1,1-dimethylethyl ester, PubChem22570, AC1Q1NDW, ACMC-1C12G, SCHEMBL352551, 3-[(Boc-amino)methyl]aniline, alpha-(Boc-amino)-m-toluidine, AMBZ0033, 3-(N-Boc-aminomethyl)-aniline, CTK4C5340, DTXSID30444751, 3-AMINO-N-BOC-BENZYLAMINE, LSOZALWRNWQPLK-UHFFFAOYSA-N, tert-butyl(3-aminobenzyl)carbamate, BCP25174, ZINC2541484, ANW-52506, AR2567, MFCD04974010, AKOS010249889, AB21434, CB-3200, MCULE-7373312793, QC-2422, 3-tert.butoxycarbonylaminomethyl-aniline, AJ-39183, AK-77339, BS-14071, DA-42195, 3-[(t-butoxycarbonylamino)-methyl]aniline, 3-Amino-N-(tert-butoxycarbonyl)benzylamine, N-(t-Butyloxycarbonyl)-3-Aminobenzylamine, 3-[(tert-Butoxycarbonylamino)methyl]aniline, AB0037747, DB-007888, TC-030019, alpha-(tert-Butoxycarbonyl)amino-m-toluidine, AM20080531, CS-0042011, FT-0080091, FT-0650822, ST24031757, Y5073, (3-aminobenzyl)-carbamic acid tert-butylester, EN300-51726, tert-Butyl 3-aminobenzylcarbamate, AldrichCPR, A21304, X-3262, N-(3-Aminobenzyl)carbamic acid tert-butyl ester, 291B665, n-(3-aminophenylmethyl)carbamic acid t-butyl ester, I01-7582, Z1259335872, Carbamic acid, (3-aminophenyl)methyl-, 1,1-dimethylethyl ester, C12H18N2O2, RW1405, CID10775412, A2718, 528882-16-8,

Complexity	236
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	222.137g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	222.288g/mol
Monoisotopic Mass	222.137g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	64.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

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