AG00ECL4

57399-97-0 | Ethyl (4-aminophenyl)carbamate

AG00ECL4

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CAS Number	57399-97-0
Catalog Number	AG00ECL4(AGN-PC-0NK2CI)
Chemical Name	Ethyl (4-aminophenyl)carbamate
IUPAC Name	ethyl N-(4-aminophenyl)carbamate
InChI	InChI=1S/C9H12N2O2/c1-2-13-9(12)11-8-5-3-7(10)4-6-8/h3-6H,2,10H2,1H3,(H,11,12)
InChI Key	SABZQUOBNXDLDV-UHFFFAOYSA-N
MDL Number	MFCD00134818
Molecular Formula	C9H12N2O2
Molecular Weight	180.2038
SMILES	O=C(OCC)NC1=CC=C(N)C=C1
Synonyms	Ethyl (4-aminophenyl)carbamate, 57399-97-0, N-(4-aminophenyl)ethoxycarboxamide, 4-Amino-phenyl-urethane, Carbamic acid, (4-aminophenyl)-, ethyl ester, AC1Q35BI, Ethyl(4-aminophenyl)carbamate, SCHEMBL854996, CTK5A6797, DTXSID60508375, ethyl N-(4-aminophenyl)carbamate, SABZQUOBNXDLDV-UHFFFAOYSA-N, ALBB-024842, ZINC2504750, MFCD00134818, SBB072360, AKOS000153799, MCULE-4339686017, AJ-36040, DA-18466, (4-Amino-phenyl)-carbamic acid ethyl ester, AB0218188, Ethyl (4-aminophenyl)carbamate, AldrichCPR, N-(4-Aminophenyl)carbamic acid ethyl ester, FT-0739929, ST45027976, EN300-41671, J3.536.127H, W-6533, ETHYL CARBAMATE, C9H12N2O2,

Complexity	165
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	180.09g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	180.207g/mol
Monoisotopic Mass	180.09g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	64.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

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