3-Anilinopropionitrile

Modify Date: 2025-08-21 07:21:11

3-Anilinopropionitrile structure	Common Name	3-Anilinopropionitrile
	CAS Number	1075-76-9	Molecular Weight	146.18900
	Density	1.08 g/cm3	Boiling Point	160 °C / 6mmHg
	Molecular Formula	C₉H₁₀N₂	Melting Point	52-53 °C(lit.)
	MSDS	N/A	Flash Point	>230 °F

Name	3-Anilinopropionitrile
Synonym	More Synonyms

Density	1.08 g/cm3
Boiling Point	160 °C / 6mmHg
Melting Point	52-53 °C(lit.)
Molecular Formula	C₉H₁₀N₂
Molecular Weight	146.18900
Flash Point	>230 °F
Exact Mass	146.08400
PSA	35.82000
LogP	2.08518
Vapour Pressure	0.00018mmHg at 25°C
Index of Refraction	1.5632 (25ºC)
InChIKey	FENJKTQEFUPECW-UHFFFAOYSA-N
SMILES	N#CCCNc1ccccc1

3-Anilinopropionitrile MSDS(Chinese)

CHEMICAL IDENTIFICATION

RTECS NUMBER :: UG0770000

CHEMICAL NAME :: Propionitrile, 3-anilino-

CAS REGISTRY NUMBER :: 1075-76-9

BEILSTEIN REFERENCE NO. :: 0509166

LAST UPDATED :: 199701

DATA ITEMS CITED :: 4

MOLECULAR FORMULA :: C9-H10-N2

MOLECULAR WEIGHT :: 146.21

WISWESSER LINE NOTATION :: NC2MR

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 4700 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: GTPZAB Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1-36, 1957-1992. For publisher information, see MTPEEI Volume(issue)/page/year: 32(9),50,1988

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 2560 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: GTPZAB Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1-36, 1957-1992. For publisher information, see MTPEEI Volume(issue)/page/year: 32(9),32,1988

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Mammal - species unspecified

DOSE/DURATION :: 4500 mg/kg

TOXIC EFFECTS :: Kidney, Ureter, Bladder - changes in tubules (including acute renal failure, acute tubular necrosis)

REFERENCE :: PJPPAA Polish Journal of Pharmacology and Pharmacy. (ARS Polona, POB 1001, 00-068 Warsaw 1, Poland) V.25- 1973- Volume(issue)/page/year: 32,223,1980

Hazard Codes	Xn:Harmful;
Risk Phrases	R20/21
Safety Phrases	S26-S37/39-S36/37
WGK Germany	3
RTECS	UG0770000
HS Code	2926909090

Precursor 9
CAS#:107-13-1 Acrylonitrile CAS#:542-76-7 3-chloropropion... CAS#:703-56-0 2-Oxazolidinone... CAS#:2417-90-5 3-Bromopropionitrile
CAS#:32316-92-0 2-Naphthalenebo... CAS#:58469-32-2 5-chloro-2-phen... CAS#:142-04-1 Anilinium chloride CAS#:100133-37-7 2-[Bis-(2-cyane...
CAS#:51078-50-3 2-((2-cyanoethy...
DownStream 10
CAS#:57662-47-2 3-(3-Methyl-1H-... CAS#:92-64-8 N-(2'-Cyanoethy... CAS#:3314-35-0 3-Amino-4,5-dih... CAS#:78331-52-9 2-cyanoethyl(ph...
CAS#:4414-81-7 3-(3-Methyl-1H-... CAS#:4742-01-2 N'-phenylpropan... CAS#:54734-95-1 3-(3-phenylindo... CAS#:5652-38-0 3-(Phenylamino)...
CAS#:61544-72-7 α-(anilinomethy... CAS#:61544-27-2 5-[[3,5-bis(met...

HS Code	2926909090
Summary	HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

Name: Discovery of Small Molecules to Inhibit Human Cytomegalovirus Nuclear Egress
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: HCMV UL50
External Id: HMS1262

Name: qHTS assay for inhibitors of human lactate dehydrogenase
Source: NCGC
Target: N/A
External Id: LDHA

Name: NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
Source: DTP/NCI
Target: N/A
External Id: MCF7_OneDose

Name: NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell...
Source: DTP/NCI
Target: N/A
External Id: IGROV1_OneDose

Name: Primary qHTS Assay for Foot and Mouth Disease Virus Antivirals against NCGC Sytravon ...
Source: NCGC
External Id: stopgo-p2-SytraCBC-dual-FF

Name: A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id: HMS979

Name: Primary qHTS Assay for Foot and Mouth Disease Virus Antivirals against NCGC Sytravon ...
Source: NCGC
External Id: stopgo-p2-SytraCBC-dual-Ren

Name: A screen for compounds that inhibit viral RNA polymerase binding and polymerization a...
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: Chain A, Poliovirus Polymerase With Gtp
External Id: HMS750

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3-anilinopropanenitrile

EINECS 214-057-6

MFCD00001953

N-(2-Cyanoethyl)aniline

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Shanghai Nianxing Industrial Co., Ltd
China
Product Name: 3-Anilinopropionitrile
Price: Check
Purity: 98.0%
Delivery: 10 Day
Contact: Yang
Email: sales@echemcloud.com

Dayang Chem (Hangzhou) Co., Ltd.
China
Product Name: 3-Anilinopropionitrile
Price: $Inquiry/100g $Inquiry/1kg $Inquiry/100kg $Inquiry/1000kg
Purity: 98.0%
Delivery: Inquiry
Contact: Ms Wang
Email: enquiry@dycnchem.com

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3-Anilinopropionitrile

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CHEMICAL IDENTIFICATION

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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3-AnilinopropionitrileBioassay

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The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.