AG00GRRY

94-12-2 | n-Propyl 4-aminobenzoate

AG00GRRY

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CAS Number	94-12-2
Catalog Number	AG00GRRY(AGN-PC-0JK7YH)
Chemical Name	n-Propyl 4-aminobenzoate
IUPAC Name	propyl 4-aminobenzoate
InChI	InChI=1S/C10H13NO2/c1-2-7-13-10(12)8-3-5-9(11)6-4-8/h3-6H,2,7,11H2,1H3
InChI Key	NBFQYHKHPBMJJV-UHFFFAOYSA-N
MDL Number	MFCD00017111
Molecular Formula	C10H13NO2
Molecular Weight	179.2157
NSC Number	23516
SMILES	O=C(OCCC)C1=CC=C(N)C=C1
UNII	5CQ88I59ZI
Synonyms	p-aminobenzoic acid propyl ester, propyl 4-aminobenzoate, propyl 4-aminobenzoate hydrobromide, Propyl 4-aminobenzoate, Risocaine, 94-12-2, Propaesin, Propazyl, Propesine, Propylcain, Raythesin, Keloform P, Propyl p-aminobenzoate, Propesin, 4-(Propoxycarbonyl)aniline, 4-aminobenzoic acid n-propyl ester, n-Propyl 4-aminobenzoate, Benzoic acid, 4-amino-, propyl ester, NSC-23516, Benzoic acid, p-amino-, propyl ester, Risocaine [USAN:INN], Risocainum [INN-Latin], P-AMINOBENZOIC ACID, PROPYL ESTER, 4-Aminobenzoic Acid Propyl Ester, Risocaina [INN-Spanish], UNII-5CQ88I59ZI, Propyl aminobenzoate, p-Aminobenzoic acid propyl ester, Propyl-p-aminobenzoate, HSDB 2198, Oxabiotic, component of, Propyl-p-amino benzoate, n-Propyl p-aminobenzoate, EINECS 202-306-1, MFCD00017111, NSC 23516, BRN 1211203, AI3-02759, 5CQ88I59ZI, NBFQYHKHPBMJJV-UHFFFAOYSA-N, NSC23516, NCGC00160681-01, DSSTox_CID_26299, DSSTox_RID_81524, DSSTox_GSID_46299, Risocainum, Risocaina, CAS-94-12-2, Propesin (6CI), Risocaine (USAN), Propyl4-Aminobenzoate, n-Propyl-4-aminobenzoate, 4-Aminobenzoic acid propyl, WLN: ZR DVO3, AC1L1O6D, p-Aminobenzoesaurepropylester, Oprea1_851203, SCHEMBL118038, ACMC-20978m, CHEMBL2107010, DTXSID3046299, CTK3J4300, Benzoic acid,4-amino-,propyl ester, KS-000015ZL, ZINC1602736, ZX-AL002019, ZX-AT003895, Tox21_111984, 5697AF, ANW-13652, OR8358, SBB015273, STK260141, AKOS000120842, Tox21_111984_1, MCULE-6772531694, PS-6053, RTR-029408, NCGC00160681-03, AJ-28036, CC-17894, CJ-25793, LS-36023, PARA-AMINOBENZOIC ACID PROPYL ESTER, AX8012150, DB-057472, TR-029408, A0274, FT-0617561, ST50185582, D05735, C-06537, SR-01000944537, SR-01000944537-1, InChI=1/C10H13NO2/c1-2-7-13-10(12)8-3-5-9(11)6-4-8/h3-6H,2,7,11H2,1H, risocain-, Benzoic acid, propyl ester, C10H13NO2, N-PROPYL4-AMINOBENZOATE, CID7174, Risocaine (propyl-4-aminobenzoate), C10-H13-N-O2, 4-14-00-01130 (Beilstein Handbook Reference), n-Propyl 4-aminobenzoate, 98% - 100G 100g,

Complexity	162
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	179.095g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	179.219g/mol
Monoisotopic Mass	179.095g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	52.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319
Packing Group
Precautionary statements	P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
UN Code

Certificate of Analysis

Lot Number