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[물질정보] diphenyl(2,4,6-trimethylbenzoyl)phosphine oxide

by 윤지윤아 2016. 5. 25.

diphenyl(2,4,6-trimethylbenzoyl)phosphine oxide

환경규제법규인 REACH에 대응하기 위해 물질이 가지고 있는 화학구조를 이용하여 알아낸 물질의 물성 및 독성 정보 데이터베이스

EC번호

278-355-8

CAS번호

75980-60-8

물질명

diphenyl(2,4,6-trimethylbenzoyl)phosphine oxide

분자식

C22H21O2P

GENERATED SMILES

Cc1cc(C)c(C(=O)P(=O)(c2ccccc2)c3ccccc3)c(C)c1

GENERATED IUPAC NAME

(mesitylcarbonyl)(diphenyl)phosphine oxide

GENERATED InChI

InChI=1/C22H21O2P/c1-16-14-17(2)21(18(3)15-16)22(23)25(24,19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-15H,1-3H3

Melting point

62

Boiling point

115

Vapor pressure

357

Water solubility

71.94

Log octanol-water coefficient (Kow)

7.742738589

Hydroxyl radical

73

rate constant

90.02

Aquatic toxicity -LC50 (fish)

6.28

Aquatic toxicity -LC50 (dapnias)

8.32

Aquatic toxicity -EC50 (green algae)

9.17

Ready biodegradability

0.12

Aqueous hydrolysis

5.23

Soil adsorption coeficient (Koc)

0.975569

BCF & BAF

97.687

Carcinogenicity

1

Irritancy

1

Lachrymation

1

Neurotoxicity and Thyroid Toxicity

0

Teratogenicity

1

Respiratory and Skin Sensitization

0

Mutagenicity

0

Daphina magna EC50

0.6086

Fathead Minnow LC50

30.8235

Aerobic biodegradability

62.6463

Developmental toxicity potential

58.1871

NTP Rodent Carcinogenicity

0

Ocular Irritancy

0

Octonal/Water LogP

548168

Rabbit Skin Irritancy

853032

Rat Chronic LOAEL

292128

(Lowest Observed Adverse Effect Level)

53973.7

Rat Inhalation Toxicity LC50

741.873

Rat Maximum Tolerated Dose (MTD)

931.989

Rat Maximum Tolerated Dose (MTD)

931.989

Rat Oral LD50

689.505

Skin Sensitization

2.9419

Weight-of-Evidence Rodent Carcinogenicity

1